molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL364956 |
|
IC50 |
= |
0.0 |
nM |
226.25 |
Fc1ccc2c(c1)CC/C2=C/c1cncnc1 |
Homo sapiens |
CHEMBL828695 |
assay format |
CHEMBL23731 |
OBDepict
H
3
C
O
O
N
N
CH
3
|
IC50 |
= |
0.1 |
nM |
244.29 |
CCOC(=O)c1cncn1C(C)c1ccccc1 |
Homo sapiens |
CHEMBL3888753 |
cell-based format |
CHEMBL451505 |
OBDepict
O
N
CH
3
N
|
IC50 |
= |
0.1 |
nM |
288.35 |
CN1C(=O)CCc2cc(-c3cncc4ccccc34)ccc21 |
Homo sapiens |
CHEMBL989835 |
cell-based format |
CHEMBL3313977 |
OBDepict
F
F
N
N
H
3
C
N
|
IC50 |
= |
0.15 |
nM |
295.29 |
Cn1c(-c2cncc3ccccc23)nc2ccc(F)c(F)c21 |
Homo sapiens |
CHEMBL3366798 |
cell-based format |
CHEMBL500392 |
OBDepict
CH
3
O
N
O
H
3
C
H
3
C
|
IC50 |
= |
0.2 |
nM |
293.37 |
COc1ccc2cc(-c3cncc(C(C)OC)c3)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3582482 |
OBDepict
F
F
N
N
N
H
3
C
CH
3
|
IC50 |
= |
0.2 |
nM |
299.32 |
Cc1cncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1C |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL4096914 |
OBDepict
F
N
N
Cl
N
OH
H
3
C
H
3
C
|
IC50 |
= |
0.2 |
nM |
305.74 |
CC(C)(O)c1cncc(-n2ncc3c(Cl)ccc(F)c32)c1 |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL1765215 |
OBDepict
O
N
N
|
IC50 |
= |
0.2 |
nM |
314.39 |
O=C1CCc2cc(-c3cncc4ccccc34)cc3c2N1CCC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL457856 |
OBDepict
CH
3
O
N
N
CH
3
O
|
IC50 |
= |
0.2 |
nM |
268.32 |
COc1cncc(-c2ccc3c(c2)CCC(=O)N3C)c1 |
Homo sapiens |
CHEMBL989835 |
cell-based format |
CHEMBL500421 |
OBDepict
H
3
C
O
N
O
H
3
C
|
IC50 |
= |
0.2 |
nM |
279.34 |
COCc1cncc(-c2ccc3cc(OC)ccc3c2)c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL456390 |
OBDepict
O
N
H
N
|
IC50 |
= |
0.2 |
nM |
274.32 |
O=C1CCc2cc(-c3cncc4ccccc34)ccc2N1 |
Homo sapiens |
CHEMBL989835 |
cell-based format |
CHEMBL1765214 |
OBDepict
O
N
N
|
IC50 |
= |
0.2 |
nM |
300.36 |
O=C1CCc2cc(-c3cncc4ccccc34)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3582477 |
OBDepict
F
F
N
N
N
HO
CH
3
CH
3
|
IC50 |
= |
0.3 |
nM |
329.35 |
CC(C)(O)c1cncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL1209696 |
OBDepict
Cl
N
H
3
C
H
S
O
O
N
N
HO
H
|
IC50 |
= |
0.3 |
nM |
431.95 |
C[C@@H](c1ccc(Cl)cc1)N1Cc2cncn2C(C[C@H](O)c2ccccc2)S1(=O)=O |
Homo sapiens |
CHEMBL1211863 |
cell-based format |
CHEMBL3397605 |
OBDepict
O
O
NH
N
|
IC50 |
= |
0.3 |
nM |
276.3 |
O=C1Nc2ccc(-c3cncc4ccccc34)cc2CO1 |
Homo sapiens |
CHEMBL3399802 |
cell-based format |
CHEMBL4069720 |
OBDepict
F
N
N
F
N
OH
H
3
C
H
3
C
|
IC50 |
= |
0.3 |
nM |
289.29 |
CC(C)(O)c1cncc(-n2ncc3c(F)ccc(F)c32)c1 |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL3582474 |
OBDepict
CH
3
O
N
N
N
F
F
|
IC50 |
= |
0.4 |
nM |
301.3 |
COc1cncc(-c2nc3cc(F)c(F)cc3n2C2CC2)c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL3099704 |
OBDepict
N
H
N
N
F
|
IC50 |
= |
0.4 |
nM |
331.39 |
N#Cc1ccc([C@H]2CCCCc3cncn32)c(-c2ccc(F)cc2)c1 |
Homo sapiens |
CHEMBL3101041 |
cell-based format |
CHEMBL3582470 |
OBDepict
Cl
F
N
N
N
|
IC50 |
= |
0.4 |
nM |
287.73 |
Fc1cc2nc(-c3cccnc3)n(C3CC3)c2cc1Cl |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL4088766 |
OBDepict
F
S
N
N
HO
N
S
O
O
CH
3
|
IC50 |
= |
0.4 |
nM |
397.5 |
CS(=O)(=O)N1CCC(C(O)c2cncnc2Sc2ccc(F)cc2)CC1 |
Homo sapiens |
CHEMBL4012481 |
cell-based format |
CHEMBL2417616 |
OBDepict
N
N
|
IC50 |
= |
0.5 |
nM |
322.41 |
c1ccc(-c2cncc(Cc3ccc(-c4ccccc4)nc3)c2)cc1 |
Homo sapiens |
CHEMBL2423498 |
cell-based format |
CHEMBL3397600 |
OBDepict
O
N
H
O
N
|
IC50 |
= |
0.5 |
nM |
276.3 |
O=C1COc2cc(-c3cncc4ccccc34)ccc2N1 |
Homo sapiens |
CHEMBL3399802 |
cell-based format |
CHEMBL500395 |
OBDepict
CH
3
O
N
OH
H
3
C
|
IC50 |
= |
0.5 |
nM |
279.34 |
COc1ccc2cc(-c3cncc(C(C)O)c3)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL499044 |
OBDepict
CH
3
O
H
3
C
N
|
IC50 |
= |
0.5 |
nM |
301.39 |
COc1ccc2c(c1)CC(C)C(c1cncc3ccccc13)=C2 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL4635011 |
OBDepict
Cl
H
3
C
CH
3
N
O
N
O
N
O
N
N
CH
3
|
IC50 |
= |
0.5 |
nM |
451.91 |
Cn1cc(C(=O)N2CC(Oc3cncc(N4C(=O)c5ccc(Cl)cc5C4(C)C)c3)C2)cn1 |
Homo sapiens |
CHEMBL4618742 |
cell-based format |
CHEMBL3582481 |
OBDepict
F
F
N
N
N
CH
3
F
|
IC50 |
= |
0.5 |
nM |
303.29 |
Cc1c(F)cncc1-c1nc2cc(F)c(F)cc2n1C1CC1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL3582483 |
OBDepict
CH
3
O
CH
3
N
N
N
F
F
|
IC50 |
= |
0.6 |
nM |
315.32 |
COc1c(C)cncc1-c1nc2cc(F)c(F)cc2n1C1CC1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL500394 |
OBDepict
CH
3
O
N
|
IC50 |
= |
0.6 |
nM |
285.35 |
COc1ccc2cc(-c3cncc4ccccc34)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3582471 |
OBDepict
N
F
N
N
N
|
IC50 |
= |
0.6 |
nM |
278.29 |
N#Cc1cc2c(cc1F)nc(-c1cccnc1)n2C1CC1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL3287192 |
OBDepict
H
3
C
N
O
N
|
IC50 |
= |
0.6 |
nM |
286.33 |
CC(=O)n1ccc2cc(-c3cncc4ccccc34)ccc21 |
Homo sapiens |
CHEMBL3293049 |
cell-based format |
CHEMBL1765207 |
OBDepict
CH
3
O
N
N
O
|
IC50 |
= |
0.6 |
nM |
280.33 |
COc1cncc(-c2cc3c4c(c2)CCN4C(=O)CC3)c1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3948337 |
OBDepict
F
N
N
N
|
IC50 |
= |
0.6 |
nM |
303.34 |
Fc1ccc2nc(-c3cncc4ccccc34)c(C3CC3)n2c1 |
Homo sapiens |
CHEMBL3872119 |
cell-based format |
CHEMBL500665 |
OBDepict
N
N
CH
3
|
IC50 |
= |
0.6 |
nM |
244.3 |
Cc1ccncc1-c1ccc2cc(C#N)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3287178 |
OBDepict
H
3
C
N
O
N
|
IC50 |
= |
0.7 |
nM |
288.35 |
CC(=O)N1CCc2cc(-c3cncc4ccccc34)ccc21 |
Homo sapiens |
CHEMBL3293049 |
cell-based format |
CHEMBL1765220 |
OBDepict
O
N
N
F
|
IC50 |
= |
0.7 |
nM |
344.39 |
O=C1CCc2cc(-c3cncc(-c4ccccc4F)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3099695 |
OBDepict
N
F
H
N
N
|
IC50 |
= |
0.7 |
nM |
227.24 |
N#Cc1ccc([C@H]2CCc3cncn32)c(F)c1 |
Homo sapiens |
CHEMBL3101041 |
cell-based format |
CHEMBL3582475 |
OBDepict
F
N
N
N
F
Cl
|
IC50 |
= |
0.8 |
nM |
305.72 |
Fc1cncc(-c2nc3cc(F)c(Cl)cc3n2C2CC2)c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL500146 |
OBDepict
CH
3
O
N
O
O
CH
3
|
IC50 |
= |
0.8 |
nM |
293.32 |
COC(=O)c1cncc(-c2ccc3cc(OC)ccc3c2)c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL500664 |
OBDepict
CH
3
O
N
CH
3
|
IC50 |
= |
0.8 |
nM |
249.31 |
COc1ccc2cc(-c3cnccc3C)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL1209694 |
OBDepict
H
3
C
O
CH
3
N
S
O
O
N
N
CH
3
H
Cl
|
IC50 |
= |
0.8 |
nM |
383.9 |
CC(C)OCC1n2cncc2CN([C@@H](C)c2ccc(Cl)cc2)S1(=O)=O |
Homo sapiens |
CHEMBL1211863 |
cell-based format |
CHEMBL1765222 |
OBDepict
F
N
N
O
|
IC50 |
= |
0.9 |
nM |
344.39 |
O=C1CCc2cc(-c3cncc(-c4ccc(F)cc4)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL4075377 |
OBDepict
F
N
N
N
HO
CH
3
CH
3
|
IC50 |
= |
0.9 |
nM |
271.3 |
CC(C)(O)c1cncc(-n2ncc3cccc(F)c32)c1 |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL3099696 |
OBDepict
N
H
3
C
H
N
N
|
IC50 |
= |
0.9 |
nM |
223.28 |
Cc1cc(C#N)ccc1[C@H]1CCc2cncn21 |
Homo sapiens |
CHEMBL3101041 |
cell-based format |
CHEMBL1765208 |
OBDepict
H
3
C
O
N
N
O
|
IC50 |
= |
0.9 |
nM |
294.35 |
COc1cncc(-c2cc3c4c(c2)CCC(=O)N4CCC3)c1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL1209693 |
OBDepict
CH
3
O
CH
3
H
3
C
N
S
O
O
N
N
CH
3
H
Cl
|
IC50 |
= |
0.9 |
nM |
397.93 |
COC(C)(C)CC1n2cncc2CN([C@@H](C)c2ccc(Cl)cc2)S1(=O)=O |
Homo sapiens |
CHEMBL1211863 |
cell-based format |
CHEMBL1765209 |
OBDepict
H
3
C
O
N
N
O
|
IC50 |
= |
1.0 |
nM |
294.35 |
CCOc1cncc(-c2cc3c4c(c2)CCN4C(=O)CC3)c1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3582476 |
OBDepict
N
F
N
N
N
F
|
IC50 |
= |
1.0 |
nM |
296.28 |
N#Cc1cc2c(cc1F)nc(-c1cncc(F)c1)n2C1CC1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL9298 |
OBDepict
N
N
N
|
IC50 |
= |
1.0 |
nM |
223.28 |
N#Cc1ccc(C2CCCc3cncn32)cc1 |
Homo sapiens |
CHEMBL831483 |
cell-based format |
CHEMBL3397603 |
OBDepict
O
N
H
N
H
N
|
IC50 |
= |
1.1 |
nM |
275.31 |
O=C1CNc2cc(-c3cncc4ccccc34)ccc2N1 |
Homo sapiens |
CHEMBL3399802 |
cell-based format |
CHEMBL1765205 |
OBDepict
O
N
N
|
IC50 |
= |
1.1 |
nM |
250.3 |
O=C1CCc2cc(-c3cccnc3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3976931 |
OBDepict
F
N
N
Cl
N
OH
CH
3
H
3
C
|
IC50 |
= |
1.2 |
nM |
305.74 |
CC(C)(O)c1cncc(-c2nc3ccc(F)cn3c2Cl)c1 |
Homo sapiens |
CHEMBL3872119 |
cell-based format |
CHEMBL500145 |
OBDepict
CH
3
O
H
3
C
N
O
H
3
C
|
IC50 |
= |
1.2 |
nM |
281.36 |
COc1cncc(C2=Cc3ccc(OC)cc3CC2C)c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3582467 |
OBDepict
N
N
N
N
|
IC50 |
= |
1.2 |
nM |
260.3 |
N#Cc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL1765232 |
OBDepict
S
N
N
|
IC50 |
= |
1.2 |
nM |
266.37 |
S=C1CCc2cc(-c3cccnc3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL3968397 |
OBDepict
F
N
N
CH
3
N
HO
CH
3
CH
3
|
IC50 |
= |
1.2 |
nM |
285.32 |
Cc1c(-c2cncc(C(C)(C)O)c2)nc2ccc(F)cn12 |
Homo sapiens |
CHEMBL3872119 |
cell-based format |
CHEMBL1765229 |
OBDepict
HO
N
N
O
|
IC50 |
= |
1.2 |
nM |
342.4 |
O=C1CCc2cc(-c3cncc(-c4cccc(O)c4)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL4080420 |
OBDepict
F
CH
3
N
N
N
OH
H
3
C
H
3
C
|
IC50 |
= |
1.3 |
nM |
285.32 |
Cc1nn(-c2cncc(C(C)(C)O)c2)c2cccc(F)c12 |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL1765219 |
OBDepict
O
N
N
|
IC50 |
= |
1.3 |
nM |
326.4 |
O=C1CCc2cc(-c3cncc(-c4ccccc4)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL1208801 |
OBDepict
Cl
N
H
3
C
H
S
O
O
N
N
|
IC50 |
= |
1.3 |
nM |
365.89 |
C[C@@H](c1ccc(Cl)cc1)N1Cc2cncn2C(CC2CC2)S1(=O)=O |
Homo sapiens |
CHEMBL1211863 |
cell-based format |
CHEMBL3313968 |
OBDepict
O
O
N
H
3
C
N
OH
F
F
F
|
IC50 |
= |
1.4 |
nM |
324.26 |
Cn1c(=O)oc2cc(-c3cncc(C(O)C(F)(F)F)c3)ccc21 |
Homo sapiens |
CHEMBL3366821 |
cell-based format |
CHEMBL1765228 |
OBDepict
CH
3
O
N
N
O
|
IC50 |
= |
1.4 |
nM |
356.43 |
COc1ccc(-c2cncc(-c3cc4c5c(c3)CCN5C(=O)CC4)c2)cc1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL1765221 |
OBDepict
F
N
N
O
|
IC50 |
= |
1.4 |
nM |
344.39 |
O=C1CCc2cc(-c3cncc(-c4cccc(F)c4)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL461884 |
OBDepict
N
N
|
IC50 |
= |
1.6 |
nM |
232.29 |
N#CC1=Cc2ccc(-c3cccnc3)cc2CC1 |
Homo sapiens |
CHEMBL989835 |
cell-based format |
CHEMBL597578 |
OBDepict
N
N
N
|
IC50 |
= |
1.7 |
nM |
259.31 |
N#Cc1ccc(Cn2cncc2-c2ccccc2)cc1 |
Homo sapiens |
CHEMBL1072072 |
cell-based format |
CHEMBL681 |
OBDepict
H
3
C
O
O
N
N
CH
3
H
|
IC50 |
= |
1.7 |
nM |
244.29 |
CCOC(=O)c1cncn1[C@H](C)c1ccccc1 |
Homo sapiens |
CHEMBL1072072 |
cell-based format |
CHEMBL3287193 |
OBDepict
CH
3
N
N
O
CH
3
|
IC50 |
= |
1.7 |
nM |
250.3 |
CC(=O)n1ccc2cc(-c3cnccc3C)ccc21 |
Homo sapiens |
CHEMBL3293049 |
cell-based format |
CHEMBL499007 |
OBDepict
H
3
C
O
N
O
|
IC50 |
= |
1.8 |
nM |
253.3 |
COc1cncc(-c2ccc3c(c2)CCC(=O)C3)c1 |
Homo sapiens |
CHEMBL989835 |
cell-based format |
CHEMBL4641359 |
OBDepict
Cl
H
3
C
CH
3
N
O
N
N
N
O
N
N
CH
3
|
IC50 |
= |
2.0 |
nM |
476.97 |
Cn1cc(C(=O)N2CC3(C2)CN(c2cncc(N4C(=O)c5ccc(Cl)cc5C4(C)C)c2)C3)cn1 |
Homo sapiens |
CHEMBL4618742 |
cell-based format |
CHEMBL3313971 |
OBDepict
N
N
N
F
CH
3
|
IC50 |
= |
2.0 |
nM |
345.42 |
CC1CCCC(c2ccc(C#N)cc2-c2ccc(F)cc2)n2cncc21 |
Homo sapiens |
CHEMBL3366814 |
single protein format |
CHEMBL3953785 |
OBDepict
NH
2
N
O
N
N
CH
3
|
IC50 |
= |
2.0 |
nM |
268.32 |
Cc1ccncc1-c1cnc2c(c1)CCCN2C(N)=O |
Homo sapiens |
CHEMBL3887526 |
single protein format |
CHEMBL3099682 |
OBDepict
H
N
N
|
IC50 |
= |
2.0 |
nM |
288.39 |
c1ccc(-c2ccccc2[C@H]2CCCCc3cncn32)cc1 |
Homo sapiens |
CHEMBL3101168 |
cell-based format |
CHEMBL3960079 |
OBDepict
CH
3
N
N
N
O
NH
2
|
IC50 |
= |
2.0 |
nM |
268.32 |
Cc1cncc(-c2cnc3c(c2)CCCN3C(N)=O)c1 |
Homo sapiens |
CHEMBL3887526 |
single protein format |
CHEMBL206351 |
OBDepict
CH
3
O
N
|
IC50 |
= |
2.0 |
nM |
237.3 |
COc1ccc2c(c1)CCC(c1cccnc1)=C2 |
Homo sapiens |
CHEMBL860940 |
cell-based format |
CHEMBL4070323 |
OBDepict
F
NH
N
N
OH
CH
3
N
S
O
O
CH
3
|
IC50 |
= |
2.0 |
nM |
394.47 |
CC(O)(c1cncnc1Nc1ccc(F)cc1)C1CCN(S(C)(=O)=O)CC1 |
Homo sapiens |
CHEMBL4012481 |
cell-based format |
CHEMBL4101709 |
OBDepict
F
N
N
N
HO
H
3
C
F
F
F
|
IC50 |
= |
2.0 |
nM |
325.26 |
CC(O)(c1cncc(-n2ncc3cc(F)ccc32)c1)C(F)(F)F |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL3099604 |
OBDepict
F
H
N
N
|
IC50 |
= |
2.0 |
nM |
306.38 |
Fc1ccc(-c2ccccc2[C@H]2CCCCc3cncn32)cc1 |
Homo sapiens |
CHEMBL3101168 |
cell-based format |
CHEMBL4070230 |
OBDepict
N
N
H
N
N
HO
N
S
O
O
CH
3
|
IC50 |
= |
2.0 |
nM |
387.47 |
CS(=O)(=O)N1CCC(C(O)c2cncnc2Nc2ccc(C#N)cc2)CC1 |
Homo sapiens |
CHEMBL4012481 |
cell-based format |
CHEMBL4475659 |
OBDepict
CH
3
HN
N
N
N
N
F
F
|
IC50 |
< |
2.0 |
nM |
301.3 |
CNc1ncncc1-c1nc2cc(F)c(F)cc2n1C1CC1 |
Homo sapiens |
CHEMBL4307089 |
cell-based format |
CHEMBL4635517 |
OBDepict
Cl
CH
3
CH
3
N
O
N
N
N
S
O
O
CH
3
|
IC50 |
= |
2.0 |
nM |
434.95 |
CC1(C)c2cc(Cl)ccc2C(=O)N1c1cncc(N2CCN(S(C)(=O)=O)CC2)c1 |
Homo sapiens |
CHEMBL4618742 |
cell-based format |
CHEMBL3582469 |
OBDepict
F
F
N
N
N
|
IC50 |
= |
2.1 |
nM |
271.27 |
Fc1cc2nc(-c3cccnc3)n(C3CC3)c2cc1F |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL502824 |
OBDepict
CH
3
O
N
O
H
3
C
|
IC50 |
= |
2.1 |
nM |
277.32 |
COc1ccc2cc(-c3cncc(C(C)=O)c3)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3287188 |
OBDepict
H
3
C
N
O
N
CH
3
|
IC50 |
= |
2.2 |
nM |
252.32 |
CC(=O)N1CCc2cc(-c3cnccc3C)ccc21 |
Homo sapiens |
CHEMBL3293049 |
cell-based format |
CHEMBL3582465 |
OBDepict
Cl
N
N
N
|
IC50 |
= |
2.2 |
nM |
269.74 |
Clc1ccc2nc(-c3cccnc3)n(C3CC3)c2c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL4126893 |
OBDepict
N
H
3
C
N
N
H
O
N
N
|
IC50 |
= |
2.2 |
nM |
317.35 |
Cc1cc(C#N)ccc1-c1cnn2c1C[C@@H](Oc1cnccn1)C2 |
Homo sapiens |
CHEMBL4124785 |
cell-based format |
CHEMBL3415172 |
OBDepict
H
3
C
N
N
N
F
N
|
IC50 |
= |
2.2 |
nM |
330.37 |
Cc1nnc2n1-c1c(F)cc(-c3cncc4ccccc34)cc1CC2 |
Homo sapiens |
CHEMBL3418338 |
cell-based format |
CHEMBL500676 |
OBDepict
CH
3
O
N
O
CH
3
|
IC50 |
= |
2.2 |
nM |
279.34 |
COCc1ccncc1-c1ccc2cc(OC)ccc2c1 |
Homo sapiens |
CHEMBL1002226 |
cell-based format |
CHEMBL3397607 |
OBDepict
O
NH
N
H
N
|
IC50 |
= |
2.2 |
nM |
275.31 |
O=C1NCc2cc(-c3cncc4ccccc34)ccc2N1 |
Homo sapiens |
CHEMBL3399802 |
cell-based format |
CHEMBL4127675 |
OBDepict
N
N
N
O
H
N
N
CH
3
N
|
IC50 |
= |
2.2 |
nM |
342.36 |
Cc1cc(C#N)ccc1-c1cnn2c1C[C@@H](Oc1ncc(C#N)cn1)C2 |
Homo sapiens |
CHEMBL4124785 |
cell-based format |
CHEMBL1765210 |
OBDepict
H
3
C
O
H
3
C
N
N
O
|
IC50 |
= |
2.2 |
nM |
308.38 |
CC(C)Oc1cncc(-c2cc3c4c(c2)CCN4C(=O)CC3)c1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL4067000 |
OBDepict
CH
3
HO
CH
3
N
N
N
F
F
F
|
IC50 |
= |
2.2 |
nM |
321.3 |
CC(C)(O)c1cncc(-n2ncc3c(C(F)(F)F)cccc32)c1 |
Homo sapiens |
CHEMBL4029972 |
cell-based format |
CHEMBL3983243 |
OBDepict
O
N
H
N
N
CH
3
N
CH
3
|
IC50 |
= |
2.2 |
nM |
242.28 |
Cc1cncc(-c2nn3c(c2C)NC(=O)CC3)c1 |
Homo sapiens |
CHEMBL3888509 |
cell-based format |
CHEMBL3313978 |
OBDepict
O
N
H
N
N
N
CH
3
|
IC50 |
= |
2.2 |
nM |
228.25 |
Cc1cncc(-c2cc3n(n2)CCC(=O)N3)c1 |
Homo sapiens |
CHEMBL3366798 |
cell-based format |
CHEMBL1765224 |
OBDepict
O
N
N
F
F
|
IC50 |
= |
2.3 |
nM |
362.38 |
O=C1CCc2cc(-c3cncc(-c4ccc(F)c(F)c4)c3)cc3c2N1CC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL4127904 |
OBDepict
N
H
3
C
N
N
H
O
|
IC50 |
= |
2.3 |
nM |
329.4 |
Cc1cc(C#N)ccc1-c1cnn2c1C[C@@H](OCc1ccccc1)C2 |
Homo sapiens |
CHEMBL4124785 |
cell-based format |
CHEMBL599603 |
OBDepict
N
N
N
F
|
IC50 |
= |
2.3 |
nM |
277.3 |
N#Cc1ccc(Cn2cncc2-c2ccccc2F)cc1 |
Homo sapiens |
CHEMBL1072072 |
cell-based format |
CHEMBL3582478 |
OBDepict
F
N
N
N
HO
CH
3
CH
3
|
IC50 |
= |
2.3 |
nM |
311.36 |
CC(C)(O)c1cncc(-c2nc3ccc(F)cc3n2C2CC2)c1 |
Homo sapiens |
CHEMBL3583831 |
cell-based format |
CHEMBL1765226 |
OBDepict
CH
3
O
N
N
O
|
IC50 |
= |
2.4 |
nM |
356.43 |
COc1ccccc1-c1cncc(-c2cc3c4c(c2)CCN4C(=O)CC3)c1 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL1209695 |
OBDepict
Cl
N
H
3
C
H
S
O
O
N
N
HO
H
|
IC50 |
= |
2.4 |
nM |
431.95 |
C[C@@H](c1ccc(Cl)cc1)N1Cc2cncn2C(C[C@@H](O)c2ccccc2)S1(=O)=O |
Homo sapiens |
CHEMBL1211863 |
cell-based format |
CHEMBL1765206 |
OBDepict
O
N
N
|
IC50 |
= |
2.4 |
nM |
264.33 |
O=C1CCc2cc(-c3cccnc3)cc3c2N1CCC3 |
Homo sapiens |
CHEMBL1768362 |
cell-based format |
CHEMBL4125850 |
OBDepict
N
CH
3
N
N
|
IC50 |
= |
2.5 |
nM |
223.28 |
Cc1cc(C#N)ccc1-c1cnc2n1CCC2 |
Homo sapiens |
CHEMBL4124785 |
cell-based format |