molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL4062266 |
|
IC50 |
= |
3.0 |
nM |
428.49 |
CCCNc1ccc2c3c(cccc13)C(=O)N(c1cc3c(cc1C)n(C)c(=O)n3C)C2=O |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4086958 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
Br
|
IC50 |
= |
4.0 |
nM |
450.29 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(Br)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4072812 |
OBDepict
H
3
C
N
N
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
4.0 |
nM |
469.55 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCN(C)CC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4440829 |
OBDepict
CH
2
N
O
N
H
N
O
N
O
CH
3
O
|
IC50 |
= |
4.0 |
nM |
422.49 |
C=CCCn1cc(-c2cnc(OCC)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4091912 |
OBDepict
H
3
C
N
N
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
6.0 |
nM |
497.6 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N(C)CCN5CCCC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4586175 |
OBDepict
CH
2
N
O
N
H
O
N
O
F
F
O
|
IC50 |
= |
6.0 |
nM |
443.45 |
C=CCCn1cc(-c2cc(OC(F)F)cc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4441257 |
OBDepict
CH
2
N
O
N
H
Cl
N
O
O
|
IC50 |
= |
6.0 |
nM |
411.89 |
C=CCCn1cc(-c2ccc(Cl)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4453202 |
OBDepict
CH
2
N
O
N
H
N
N
O
N
H
3
C
O
|
IC50 |
= |
6.0 |
nM |
445.52 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3ncn(CC)c3c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4566599 |
OBDepict
CH
2
N
O
N
H
N
O
N
O
H
3
C
O
|
IC50 |
= |
7.0 |
nM |
408.46 |
C=CCCn1cc(-c2cnc(OC)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4092917 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
N
|
IC50 |
= |
7.0 |
nM |
454.53 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCCCC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4059651 |
OBDepict
HO
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
7.0 |
nM |
443.5 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(CCCCO)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4075478 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
Cl
|
IC50 |
= |
8.0 |
nM |
405.84 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(Cl)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4086276 |
OBDepict
HO
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
8.0 |
nM |
429.48 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(CCCO)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4455513 |
OBDepict
CH
2
N
O
N
H
N
N
N
O
CH
3
O
|
IC50 |
= |
10.0 |
nM |
431.5 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3c(c2)ncn3C)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4463538 |
OBDepict
H
2
C
N
O
N
H
N
N
N
O
H
3
C
O
|
IC50 |
= |
10.0 |
nM |
431.5 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)cc3c2ncn3C)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4520419 |
OBDepict
CH
2
N
O
N
H
F
N
O
O
|
IC50 |
= |
10.0 |
nM |
395.43 |
C=CCCn1cc(-c2ccc(F)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4483587 |
OBDepict
CH
3
O
NH
N
H
O
N
N
N
N
H
3
C
H
CH
3
H
3
C
O
O
|
IC50 |
< |
10.0 |
nM |
522.65 |
COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ccc2c(n1)N(C1CCOCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4437997 |
OBDepict
CH
2
N
O
N
H
F
F
N
O
O
|
IC50 |
= |
11.0 |
nM |
413.42 |
C=CCCn1cc(-c2cc(F)c(F)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4459660 |
OBDepict
CH
2
N
O
N
H
N
CH
3
N
O
O
|
IC50 |
= |
13.0 |
nM |
392.46 |
C=CCCn1cc(-c2cnc(C)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4077317 |
OBDepict
HO
O
N
O
H
3
C
N
H
3
C
N
O
CH
3
|
IC50 |
= |
13.0 |
nM |
387.4 |
Cc1cc2c(cc1N1C(=O)c3cccc4cc(O)cc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4076067 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
N
N
|
IC50 |
= |
14.0 |
nM |
509.61 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCN(CC6CC6)CC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4448723 |
OBDepict
CH
2
N
O
N
H
N
N
O
O
|
IC50 |
= |
15.0 |
nM |
402.45 |
C=CCCn1cc(-c2cc(C#N)cc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4104538 |
OBDepict
H
3
C
O
N
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
15.0 |
nM |
484.56 |
COC1CCN(c2ccc3c4c(cccc24)C(=O)N(c2cc4c(cc2C)n(C)c(=O)n4C)C3=O)CC1 |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4589721 |
OBDepict
CH
3
O
N
H
HN
O
N
N
N
N
H
3
C
H
H
3
C
CH
3
O
|
IC50 |
= |
16.0 |
nM |
506.65 |
COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ccc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4459431 |
OBDepict
CH
2
N
O
N
H
N
N
O
O
|
IC50 |
= |
16.0 |
nM |
378.43 |
C=CCCn1cc(-c2cncc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4468549 |
OBDepict
CH
2
N
O
N
H
N
N
O
N
H
O
|
IC50 |
= |
16.0 |
nM |
417.47 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3nc[nH]c3c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4513694 |
OBDepict
CH
2
N
O
N
H
N
N
O
N
CH
3
O
|
IC50 |
= |
16.0 |
nM |
431.5 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3ncn(C)c3c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4445482 |
OBDepict
H
2
C
N
O
N
H
N
N
N
O
H
3
C
O
|
IC50 |
= |
16.0 |
nM |
445.52 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)c3c(c2)ncn3CC)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4483679 |
OBDepict
CH
2
N
O
N
H
F
N
O
O
|
IC50 |
= |
17.0 |
nM |
395.43 |
C=CCCn1cc(-c2cc(F)cc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4081145 |
OBDepict
Br
O
N
O
H
3
C
N
H
3
C
N
O
CH
3
|
IC50 |
= |
17.0 |
nM |
450.29 |
Cc1cc2c(cc1N1C(=O)c3cccc4cc(Br)cc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4065133 |
OBDepict
HO
N
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
19.0 |
nM |
470.53 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCC(O)CC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4099171 |
OBDepict
N
O
N
O
H
3
C
N
H
3
C
N
O
CH
3
|
IC50 |
= |
22.0 |
nM |
396.41 |
Cc1cc2c(cc1N1C(=O)c3cccc4cc(C#N)cc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4463398 |
OBDepict
CH
2
N
O
N
H
N
O
O
|
IC50 |
= |
23.0 |
nM |
377.44 |
C=CCCn1cc(-c2cccc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4064164 |
OBDepict
CH
3
N
H
3
C
N
N
O
N
O
H
3
C
N
N
H
3
C
CH
3
O
|
IC50 |
= |
25.0 |
nM |
526.64 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCN(CCN(C)C)CC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4448345 |
OBDepict
CH
2
N
O
N
H
NH
2
N
O
O
|
IC50 |
= |
26.0 |
nM |
392.46 |
C=CCCn1cc(-c2cc(N)cc(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4534244 |
OBDepict
CH
2
N
O
N
H
N
N
N
O
H
O
|
IC50 |
= |
28.0 |
nM |
417.47 |
C=CCCn1cc(-c2cc(C(=O)N3CCOCC3)cc3[nH]cnc23)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4534000 |
OBDepict
CH
3
N
NH
O
O
HN
N
N
N
CH
3
H
H
3
C
O
|
IC50 |
= |
31.0 |
nM |
560.74 |
C[C@@H]1C(=O)N(C)c2ccc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC3CCCC3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4076603 |
OBDepict
H
2
N
O
N
O
H
3
C
N
H
3
C
N
O
CH
3
|
IC50 |
= |
33.0 |
nM |
386.41 |
Cc1cc2c(cc1N1C(=O)c3cccc4cc(N)cc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4465624 |
OBDepict
CH
2
N
O
N
H
CH
3
N
O
O
|
IC50 |
= |
35.0 |
nM |
391.47 |
C=CCCn1cc(-c2ccc(C)c(C(=O)N3CCOCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4483624 |
OBDepict
CH
2
N
O
N
H
N
O
|
IC50 |
= |
35.0 |
nM |
361.45 |
C=CCCn1cc(-c2cccc(C(=O)N3CCCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4542872 |
OBDepict
CH
3
O
NH
N
O
N
N
N
HO
H
3
C
H
CH
3
O
O
|
IC50 |
= |
38.0 |
nM |
509.61 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(C1CCOCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4466746 |
OBDepict
H
2
C
N
O
N
H
N
O
CH
3
CH
3
|
IC50 |
= |
46.0 |
nM |
363.46 |
C=CCCn1cc(-c2cccc(C(=O)N(CC)CC)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4436158 |
OBDepict
H
2
C
N
O
N
H
N
O
CH
3
CH
3
|
IC50 |
= |
46.0 |
nM |
335.41 |
C=CCCn1cc(-c2cccc(C(=O)N(C)C)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4064292 |
OBDepict
H
3
C
N
H
3
C
N
N
N
H
3
C
O
O
CH
3
O
|
IC50 |
= |
55.0 |
nM |
400.44 |
CN(C)c1cc2c(cc1N1C(=O)c3cccc4cccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4068180 |
OBDepict
O
N
O
CH
3
N
CH
3
N
+
N
O
H
3
C
O
_
O
|
IC50 |
= |
58.0 |
nM |
416.39 |
Cc1cc2c(cc1N1C(=O)c3cccc4cc([N+](=O)[O-])cc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4436408 |
OBDepict
H
3
C
N
CH
3
O
N
CH
3
N
O
H
|
IC50 |
= |
59.0 |
nM |
295.34 |
CN(C)C(=O)c1cccc(-c2cn(C)c(=O)c3[nH]ccc23)c1 |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4098824 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
|
IC50 |
= |
60.0 |
nM |
371.4 |
Cc1cc2c(cc1N1C(=O)c3cccc4cccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4573352 |
OBDepict
H
3
C
O
N
H
NH
O
N
N
N
N
CH
3
H
H
3
C
O
|
IC50 |
= |
63.0 |
nM |
478.6 |
COc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ccc2c(n1)N1CCCC[C@@H]1C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4518929 |
OBDepict
CH
2
N
O
N
H
N
O
CH
3
|
IC50 |
= |
67.0 |
nM |
403.53 |
C=CCCn1cc(-c2cccc(C(=O)N(C)C3CCCCC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4556917 |
OBDepict
CH
3
O
NH
N
O
N
N
N
HO
H
3
C
H
CH
3
O
|
IC50 |
= |
72.0 |
nM |
507.64 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(C1CCCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4474288 |
OBDepict
CH
2
N
O
N
N
H
CH
3
N
H
O
O
H
3
C
N
H
O
N
H
3
C
|
IC50 |
= |
82.0 |
nM |
562.72 |
C=CCCN1C(=O)[C@@H](C)N(C2CCOCC2)c2nc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)ccc21 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4470836 |
OBDepict
OH
N
N
O
N
N
O
H
CH
2
|
IC50 |
= |
83.0 |
nM |
420.51 |
C=CCCn1cc(-c2cccc(C(=O)N3CCN(CCO)CC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4440443 |
OBDepict
CH
3
N
HN
O
N
H
N
N
N
N
CH
3
H
CH
3
O
|
IC50 |
= |
87.0 |
nM |
477.61 |
C[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4075962 |
OBDepict
Br
N
N
N
CH
3
O
O
CH
3
O
|
IC50 |
= |
87.0 |
nM |
436.27 |
Cn1c(=O)n(C)c2cc(N3C(=O)c4cccc5cccc(c45)C3=O)c(Br)cc21 |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4572531 |
OBDepict
CH
2
N
O
N
H
N
O
N
CH
3
|
IC50 |
= |
89.0 |
nM |
390.49 |
C=CCCn1cc(-c2cccc(C(=O)N3CCN(C)CC3)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4310221 |
single protein format |
CHEMBL4539891 |
OBDepict
H
3
C
N
N
H
O
O
N
H
CH
3
H
3
C
N
N
N
CH
3
H
CH
3
O
|
IC50 |
= |
89.0 |
nM |
534.71 |
CC(C)Oc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ccc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4067968 |
OBDepict
H
3
C
N
N
N
CH
3
O
O
CH
3
O
N
O
|
IC50 |
= |
90.0 |
nM |
456.5 |
Cc1cc2c(cc1N1C(=O)c3cccc4c(N5CCOCC5)ccc(c34)C1=O)n(C)c(=O)n2C |
Homo sapiens |
CHEMBL4051534 |
assay format |
CHEMBL4466613 |
OBDepict
H
3
C
O
N
H
N
O
N
N
N
OH
CH
3
H
CH
3
O
|
IC50 |
= |
93.0 |
nM |
493.61 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL3609314 |
OBDepict
CH
3
H
N
O
N
N
CH
3
N
N
H
O
N
H
O
N
H
3
C
|
IC50 |
= |
100.0 |
nM |
575.76 |
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC3CCCC3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4437749 |
OBDepict
CH
3
H
N
O
N
N
H
3
C
N
N
H
O
HN
O
N
CH
3
|
IC50 |
= |
110.0 |
nM |
561.73 |
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC3CCC3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4102588 |
OBDepict
CH
3
N
N
H
O
N
CH
3
N
O
H
|
IC50 |
= |
130.0 |
nM |
288.35 |
CN1CCC(NC(=O)c2cn(C)c(=O)c3[nH]ccc23)CC1 |
Homo sapiens |
CHEMBL4058266 |
cell-based format |
CHEMBL3609309 |
OBDepict
H
3
C
H
N
O
N
N
CH
3
N
N
H
NH
O
N
CH
3
|
IC50 |
= |
150.0 |
nM |
491.64 |
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL513909 |
OBDepict
CH
3
H
N
O
N
N
CH
3
N
N
H
O
H
3
C
HN
O
N
CH
3
|
IC50 |
= |
160.0 |
nM |
521.67 |
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4468126 |
OBDepict
CH
3
H
N
O
N
N
CH
3
N
HN
O
H
3
C
CH
3
NH
O
N
CH
3
|
IC50 |
= |
210.0 |
nM |
549.72 |
CC[C@@H]1C(=O)N(C)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC(C)C)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4475297 |
OBDepict
H
3
C
O
N
H
N
O
N
N
N
OH
CH
3
H
O
|
IC50 |
= |
210.0 |
nM |
465.55 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N1CCCC[C@@H]1C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4572284 |
OBDepict
CH
3
O
NH
N
O
N
N
N
HO
H
3
C
H
CH
3
O
|
IC50 |
= |
240.0 |
nM |
521.66 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(C1CCCCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4447984 |
OBDepict
H
3
C
O
N
H
N
O
N
N
N
OH
CH
3
H
CH
3
O
H
3
C
H
3
C
|
IC50 |
= |
300.0 |
nM |
521.66 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(C1CCC(C)(C)C1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4552957 |
OBDepict
H
3
C
N
N
H
O
O
N
H
CH
3
H
3
C
N
N
N
N
CH
3
H
CH
3
O
|
IC50 |
= |
320.0 |
nM |
535.69 |
CC(C)Oc1cc(C(=O)NC2CCN(C)CC2)ccc1Nc1ncc2c(n1)N(C1CCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4590890 |
OBDepict
CH
3
N
HN
O
N
H
N
N
N
CH
3
H
CH
3
O
|
IC50 |
= |
340.0 |
nM |
476.63 |
C[C@@H]1C(=O)N(C)c2ccc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL3609300 |
OBDepict
CH
3
O
HN
N
H
O
N
N
N
N
N
H
CH
3
CH
3
O
H
3
C
|
IC50 |
= |
410.0 |
nM |
535.69 |
CC[C@@H]1C(=O)N(CC)c2cnc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4519632 |
OBDepict
H
3
C
N
O
N
H
N
O
CH
3
CH
3
|
IC50 |
= |
410.0 |
nM |
335.41 |
C/C=C/Cn1cc(-c2cccc(C(=O)N(C)C)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4425852 |
single protein format |
CHEMBL4524310 |
OBDepict
CH
3
H
N
O
N
N
CH
3
N
H
O
H
3
C
HN
O
N
CH
3
|
IC50 |
= |
450.0 |
nM |
520.68 |
CC[C@@H]1C(=O)N(C)c2ccc(Nc3ccc(C(=O)NC4CCN(C)CC4)cc3OC)nc2N1C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4514849 |
OBDepict
H
2
C
N
O
N
N
H
H
3
C
N
H
O
CH
3
N
O
OH
|
IC50 |
= |
570.0 |
nM |
533.67 |
C=CCCN1C(=O)[C@@H](C)N(C2CCCC2)c2nc(Nc3ccc(C(=O)N4CCC(O)CC4)cc3OC)ccc21 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4476205 |
OBDepict
H
3
C
O
N
H
N
O
N
N
OH
CH
3
H
CH
3
O
|
IC50 |
= |
580.0 |
nM |
492.62 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(c1)N(C1CCCC1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4470053 |
OBDepict
CH
3
O
HN
N
O
N
N
N
OH
CH
3
H
H
3
C
O
|
IC50 |
= |
720.0 |
nM |
515.61 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(n1)N(Cc1ccccc1)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4521536 |
OBDepict
CH
3
O
N
H
N
O
O
N
CH
3
N
OH
H
3
C
H
H
3
C
O
|
IC50 |
= |
750.0 |
nM |
522.65 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1cc2c(cc1OC)N(C)C(=O)[C@@H](C)N2C1CCCC1 |
Homo sapiens |
CHEMBL4308743 |
assay format |
CHEMBL4460783 |
OBDepict
CH
2
N
O
N
H
N
O
H
3
C
CH
3
|
IC50 |
= |
770.0 |
nM |
321.38 |
C=CCn1cc(-c2cccc(C(=O)N(C)C)c2)c2cc[nH]c2c1=O |
Homo sapiens |
CHEMBL4425852 |
single protein format |
CHEMBL4546931 |
OBDepict
CH
3
O
N
H
N
O
CH
3
N
N
CH
3
OH
CH
3
H
H
3
C
O
|
IC50 |
= |
980.0 |
nM |
452.56 |
COc1cc(C(=O)N2CCC(O)CC2)ccc1Nc1ccc2c(c1C)N(C)[C@H](C)C(=O)N2C |
Homo sapiens |
CHEMBL4308743 |
assay format |