molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3354625 |
|
IC50 |
= |
0.08 |
nM |
433.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(F)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354624 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
F
|
IC50 |
= |
0.08 |
nM |
433.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1F |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354627 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
F
F
|
IC50 |
= |
0.08 |
nM |
483.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(C(F)(F)F)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354635 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
F
F
|
IC50 |
= |
0.1 |
nM |
483.53 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(C(F)(F)F)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354634 |
OBDepict
OH
H
N
H
OH
H
OH
H
OH
O
F
F
F
|
IC50 |
= |
0.1 |
nM |
483.53 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1C(F)(F)F |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354626 |
OBDepict
OH
H
N
H
OH
H
OH
H
OH
O
F
F
F
|
IC50 |
= |
0.12 |
nM |
483.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1C(F)(F)F |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354636 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
F
|
IC50 |
= |
0.4 |
nM |
433.52 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1F |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354041 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
|
IC50 |
= |
0.5 |
nM |
429.56 |
Cc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354637 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
|
IC50 |
= |
0.6 |
nM |
433.52 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)c(F)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354019 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
|
IC50 |
= |
1.0 |
nM |
397.56 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1C2CC3CC(C2)CC1C3 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354021 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
1.0 |
nM |
339.43 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354022 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
1.0 |
nM |
389.49 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccccc2c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354035 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
1.0 |
nM |
389.49 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccccc2c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354629 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
H
|
IC50 |
= |
1.0 |
nM |
429.56 |
C[C@@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)c1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354037 |
OBDepict
HO
H
N
H
HO
H
HO
H
HO
O
|
IC50 |
= |
1.0 |
nM |
463.57 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccc3cccc4ccc1c2c34 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354048 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
|
IC50 |
= |
1.0 |
nM |
433.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(F)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354049 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
|
IC50 |
= |
1.0 |
nM |
433.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cccc(F)c2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL574645 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
1.0 |
nM |
397.56 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL1040323 |
single protein format |
CHEMBL3354621 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
F
F
O
|
IC50 |
= |
1.0 |
nM |
451.51 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC(F)(F)COCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL4459011 |
OBDepict
CH
3
O
N
OH
HO
HO
HO
|
IC50 |
= |
1.0 |
nM |
333.47 |
CCCCCCOCCCCCN1CC(O)C(O)C(O)C1CO |
Homo sapiens |
CHEMBL4395493 |
cell-based format |
CHEMBL1088158 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
1.0 |
nM |
397.56 |
OC[C@@H]1[C@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354046 |
OBDepict
N
O
N
H
H
HO
HO
H
HO
H
HO
|
IC50 |
= |
2.0 |
nM |
440.54 |
N#Cc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354633 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
F
F
O
|
IC50 |
= |
2.0 |
nM |
451.51 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC(F)(F)COCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354016 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
2.0 |
nM |
411.58 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354063 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
2.0 |
nM |
415.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1cccc(-c2ccccc2)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354632 |
OBDepict
HO
H
N
H
HO
H
OH
F
F
O
H
OH
|
IC50 |
= |
2.0 |
nM |
451.51 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CC(F)(F)CCCOCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354054 |
OBDepict
HO
H
N
H
OH
H
HO
H
HO
O
O
O
|
IC50 |
= |
2.0 |
nM |
459.54 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCO3)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354051 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
Cl
|
IC50 |
= |
2.0 |
nM |
449.98 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(Cl)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354631 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
2.0 |
nM |
415.53 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1cccc(-c2ccccc2)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354050 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
F
|
IC50 |
= |
2.0 |
nM |
433.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2F)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354032 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
|
IC50 |
= |
2.0 |
nM |
397.56 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1C2CC3CC(C2)CC1C3 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354040 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
|
IC50 |
= |
2.0 |
nM |
429.56 |
Cc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354025 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
2.0 |
nM |
415.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354628 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
H
|
IC50 |
= |
2.0 |
nM |
429.56 |
C[C@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)c1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL450985 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
2.0 |
nM |
331.5 |
CCCCCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL971353 |
assay format |
CHEMBL3354638 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
2.0 |
nM |
415.53 |
OC[C@@H]1[C@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354029 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
2.5 |
nM |
411.58 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354045 |
OBDepict
N
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
3.0 |
nM |
440.54 |
N#Cc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354044 |
OBDepict
CH
3
O
O
N
H
H
OH
OH
H
OH
H
OH
|
IC50 |
= |
3.0 |
nM |
445.56 |
COc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354062 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
|
IC50 |
= |
3.0 |
nM |
415.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1-c1ccccc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354039 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
|
IC50 |
= |
3.0 |
nM |
429.56 |
Cc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354038 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
3.0 |
nM |
415.53 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354064 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
N
|
IC50 |
= |
3.0 |
nM |
416.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccccc2)cn1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354034 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
3.0 |
nM |
339.43 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354024 |
OBDepict
HO
H
N
H
HO
H
HO
H
HO
O
|
IC50 |
= |
3.0 |
nM |
463.57 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc2ccc3cccc4ccc1c2c34 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354630 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
|
IC50 |
= |
3.0 |
nM |
415.53 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccccc1-c1ccccc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354623 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
H
|
IC50 |
= |
3.0 |
nM |
429.56 |
C[C@@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)c1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354622 |
OBDepict
OH
H
N
H
HO
H
HO
H
OH
O
CH
3
H
|
IC50 |
= |
3.0 |
nM |
429.56 |
C[C@H](OCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)c1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL4559665 |
OBDepict
HO
N
HO
OH
OH
O
|
IC50 |
= |
4.0 |
nM |
397.56 |
OCC1C(O)C(O)C(O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL4395493 |
cell-based format |
CHEMBL3354014 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
4.0 |
nM |
345.48 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1CCCCC1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354060 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
N
F
|
IC50 |
= |
4.0 |
nM |
434.51 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccnc(F)c2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354047 |
OBDepict
N
O
N
H
H
HO
HO
H
HO
H
HO
|
IC50 |
= |
5.0 |
nM |
440.54 |
N#Cc1ccccc1-c1ccc(COCCCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354061 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
N
F
|
IC50 |
= |
5.0 |
nM |
434.51 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(F)nc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354015 |
OBDepict
OH
H
N
H
HO
H
OH
H
OH
|
IC50 |
= |
5.0 |
nM |
379.54 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC/C=CC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354026 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
|
IC50 |
= |
6.0 |
nM |
345.48 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC1CCCCC1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL408500 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
7.0 |
nM |
289.42 |
CCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354028 |
OBDepict
OH
H
N
H
HO
H
OH
H
OH
|
IC50 |
= |
8.0 |
nM |
379.54 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCC/C=CC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651630 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
8.0 |
nM |
333.47 |
CCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL2170199 |
OBDepict
HO
H
N
H
OH
H
OH
H
OH
N
H
O
|
IC50 |
= |
9.0 |
nM |
410.56 |
O=C(CCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO)NC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354042 |
OBDepict
CH
3
O
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
10.0 |
nM |
445.56 |
COc1ccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651627 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
10.0 |
nM |
289.42 |
CCCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354052 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
F
F
|
IC50 |
= |
10.0 |
nM |
483.53 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc(C(F)(F)F)cc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354058 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
N
|
IC50 |
= |
10.0 |
nM |
416.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cccnc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354620 |
OBDepict
HO
H
N
H
HO
H
OH
F
F
O
H
OH
|
IC50 |
= |
10.0 |
nM |
451.51 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CC(F)(F)CCCOCc1ccc(-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354057 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
N
|
IC50 |
= |
10.0 |
nM |
416.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccncc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354017 |
OBDepict
OH
H
N
H
HO
H
OH
H
OH
|
IC50 |
= |
10.0 |
nM |
381.56 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651632 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
10.0 |
nM |
361.52 |
CCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651637 |
OBDepict
H
3
C
O
N
H
H
HO
OH
H
OH
H
HO
|
IC50 |
= |
15.0 |
nM |
347.5 |
CCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651638 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
15.0 |
nM |
361.52 |
CCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354056 |
OBDepict
HO
H
N
H
HO
H
OH
H
OH
O
O
O
|
IC50 |
= |
15.0 |
nM |
487.59 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCCCO3)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651631 |
OBDepict
H
3
C
O
N
H
H
HO
OH
H
OH
H
HO
|
IC50 |
= |
15.0 |
nM |
347.5 |
CCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354053 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
F
F
F
F
F
F
|
IC50 |
= |
15.0 |
nM |
551.52 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354027 |
OBDepict
HO
H
N
H
OH
H
OH
H
OH
N
H
O
|
IC50 |
= |
15.0 |
nM |
410.56 |
O=C(CCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO)NC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651635 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
15.0 |
nM |
319.44 |
CCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL590070 |
OBDepict
CH
O
O
N
H
O
N
H
H
HO
HO
H
HO
H
HO
|
IC50 |
= |
20.0 |
nM |
482.53 |
C#CCOc1ccc(C(=O)c2ccc(C(=O)NCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)cc1 |
Homo sapiens |
CHEMBL1070064 |
single protein format |
CHEMBL3354043 |
OBDepict
H
3
C
O
O
N
H
H
HO
OH
H
OH
H
OH
|
IC50 |
= |
20.0 |
nM |
445.56 |
COc1cccc(-c2ccc(COCCCCCN3C[C@H](O)[C@@H](O)[C@H](O)[C@H]3CO)cc2)c1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL485840 |
OBDepict
CH
3
O
N
O
H
H
OH
HO
H
HO
H
OH
|
IC50 |
= |
20.0 |
nM |
333.43 |
CCCCCCCCCOC(=O)N1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL971353 |
assay format |
CHEMBL206468 |
OBDepict
OH
H
N
H
H
HO
H
HO
|
IC50 |
= |
20.0 |
nM |
147.17 |
OC[C@H]1CNC[C@@H](O)[C@@H]1O |
Homo sapiens |
CHEMBL4276022 |
assay format |
CHEMBL1651552 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
20.0 |
nM |
275.39 |
CCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651626 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
20.0 |
nM |
275.39 |
CCCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354030 |
OBDepict
OH
H
N
H
HO
H
OH
H
OH
|
IC50 |
= |
20.0 |
nM |
381.56 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354059 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
N
N
|
IC50 |
= |
25.0 |
nM |
417.51 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2cncnc2)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL1651636 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
25.0 |
nM |
333.47 |
CCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354055 |
OBDepict
OH
H
N
H
OH
H
HO
H
HO
O
O
O
|
IC50 |
= |
30.0 |
nM |
473.57 |
OC[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCc1ccc(-c2ccc3c(c2)OCCO3)cc1 |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL2011641 |
OBDepict
H
OH
N
H
OH
H
OH
H
CH
3
O
|
IC50 |
= |
30.0 |
nM |
381.56 |
C[C@@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL2015864 |
single protein format |
CHEMBL1086996 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
30.0 |
nM |
397.56 |
OC[C@H]1[C@@H](O)[C@H](O)[C@@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL187158 |
OBDepict
CH
3
N
OH
HO
HO
HO
|
IC50 |
= |
35.0 |
nM |
289.42 |
CCCCCCCCCN1CC(O)C(O)C(O)C1CO |
Homo sapiens |
CHEMBL4395493 |
cell-based format |
CHEMBL4288931 |
OBDepict
H
3
C
H
HN
H
OH
H
OH
H
HO
|
IC50 |
= |
40.0 |
nM |
273.42 |
CCCCCCCCC[C@H]1NC[C@@H](O)[C@@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL4276022 |
assay format |
CHEMBL1651629 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
40.0 |
nM |
319.44 |
CCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651555 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
40.0 |
nM |
261.36 |
CCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651633 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
40.0 |
nM |
375.55 |
CCCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL4577406 |
OBDepict
CH
3
O
N
OH
HO
HO
HO
|
IC50 |
= |
44.0 |
nM |
375.55 |
CCCCCCCCCOCCCCCN1CC(O)C(O)C(O)C1CO |
Homo sapiens |
CHEMBL4395493 |
cell-based format |
CHEMBL1651551 |
OBDepict
CH
3
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
45.0 |
nM |
261.36 |
CCCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651639 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
45.0 |
nM |
375.55 |
CCCCCCCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL1651628 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
60.0 |
nM |
305.42 |
CCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL4435506 |
OBDepict
OH
H
N
H
OH
H
OH
H
HO
O
|
IC50 |
= |
65.0 |
nM |
397.56 |
OC[C@H]1[C@H](O)[C@@H](O)[C@H](O)CN1CCCCCOCC12CC3CC(CC(C3)C1)C2 |
Homo sapiens |
CHEMBL4395493 |
cell-based format |
CHEMBL589341 |
OBDepict
CH
O
O
NH
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
75.0 |
nM |
434.49 |
C#CCOc1ccc(C(=O)CCC(=O)NCCCN2C[C@H](O)[C@@H](O)[C@H](O)[C@H]2CO)cc1 |
Homo sapiens |
CHEMBL1070064 |
single protein format |
CHEMBL1651634 |
OBDepict
CH
3
O
N
H
H
OH
HO
H
HO
H
HO
|
IC50 |
= |
90.0 |
nM |
305.42 |
CCCCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL1656919 |
single protein format |
CHEMBL3354020 |
OBDepict
HO
H
N
H
OH
H
OH
H
OH
O
H
3
C
H
3
C
CH
3
H
3
C
|
IC50 |
= |
100.0 |
nM |
467.69 |
CC(C)=CCC/C(C)=C/CC/C(C)=C/CCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |
Homo sapiens |
CHEMBL3384691 |
single protein format |
CHEMBL3354033 |
OBDepict
HO
H
N
H
OH
H
OH
H
OH
O
H
3
C
H
3
C
CH
3
H
3
C
|
IC50 |
= |
100.0 |
nM |
467.69 |
CC(C)=CCC/C(C)=C/CC/C(C)=C/CCOCCCCCN1C[C@H](O)[C@@H](O)[C@H](O)[C@@H]1CO |
Homo sapiens |
CHEMBL3384691 |
single protein format |