molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3781913 |
|
IC50 |
= |
8.0 |
nM |
400.49 |
COc1ccccc1N1CCCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780239 |
OBDepict
CH
3
O
N
F
N
N
N
N
N
|
IC50 |
= |
10.0 |
nM |
404.45 |
COc1ccc(F)cc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4645691 |
OBDepict
CH
3
N
H
CH
3
H
3
C
O
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
12.0 |
nM |
498.59 |
CCC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4647311 |
OBDepict
O
NH
O
CH
3
CH
3
H
3
C
N
N
N
H
O
N
N
H
|
IC50 |
= |
26.0 |
nM |
498.59 |
CC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COCC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4634839 |
OBDepict
CH
3
NH
CH
3
O
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
33.0 |
nM |
512.61 |
CCC(CC)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COCC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781331 |
OBDepict
CH
3
O
N
O
H
2
N
N
N
N
N
N
|
IC50 |
= |
37.0 |
nM |
429.48 |
COc1ccc(C(N)=O)cc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781548 |
OBDepict
CH
3
O
N
N
N
N
N
N
F
|
IC50 |
= |
40.0 |
nM |
404.45 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2F)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780972 |
OBDepict
CH
3
O
N
F
N
N
N
N
N
|
IC50 |
= |
40.0 |
nM |
404.45 |
COc1cc(F)ccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781151 |
OBDepict
CH
3
O
N
N
N
N
N
N
F
|
IC50 |
= |
46.0 |
nM |
404.45 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccc(F)cc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4634011 |
OBDepict
O
HN
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
47.0 |
nM |
496.57 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1)NC1CCCC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780144 |
OBDepict
N
N
O
H
3
C
N
N
N
N
N
|
IC50 |
= |
50.0 |
nM |
411.47 |
COc1ccc(C#N)cc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4633651 |
OBDepict
O
NH
O
CH
3
CH
3
H
3
C
N
N
N
H
NH
N
N
H
|
IC50 |
= |
58.0 |
nM |
497.6 |
CC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CNCC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781149 |
OBDepict
OH
N
N
N
N
N
N
|
IC50 |
= |
60.0 |
nM |
372.43 |
Oc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780372 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
60.0 |
nM |
387.45 |
COc1ccncc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780785 |
OBDepict
CH
3
O
N
N
N
N
N
N
|
IC50 |
= |
64.0 |
nM |
386.46 |
COc1ccccc1N1CCN(c2ncnc3c2ncn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4638234 |
OBDepict
O
N
H
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
68.0 |
nM |
482.54 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1)NC1CCC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780717 |
OBDepict
N
N
N
N
N
N
N
|
IC50 |
= |
69.0 |
nM |
381.44 |
N#Cc1cccc(N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)c1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781835 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
70.0 |
nM |
387.45 |
COc1cccnc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780460 |
OBDepict
CH
3
O
N
N
N
N
N
N
F
F
|
IC50 |
= |
90.0 |
nM |
422.44 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cc(F)cc(F)c2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780043 |
OBDepict
CH
3
O
N
N
N
N
N
N
CH
3
|
IC50 |
= |
96.0 |
nM |
400.49 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cccc(C)c2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4648466 |
OBDepict
CH
3
N
H
CH
3
O
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
97.0 |
nM |
470.53 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780235 |
OBDepict
CH
3
O
N
N
N
N
N
N
O
CH
3
|
IC50 |
= |
110.0 |
nM |
416.49 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2OC)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780527 |
OBDepict
CH
3
O
N
N
N
N
N
N
|
IC50 |
= |
120.0 |
nM |
378.48 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3C2CCCC2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781308 |
OBDepict
CH
3
O
N
CH
3
N
N
N
N
N
|
IC50 |
= |
120.0 |
nM |
400.49 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1C |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781741 |
OBDepict
CH
3
O
N
N
N
N
N
N
F
|
IC50 |
= |
120.0 |
nM |
404.45 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cccc(F)c2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4637134 |
OBDepict
CH
3
NH
CH
3
O
O
N
N
N
H
HN
N
N
H
|
IC50 |
= |
121.0 |
nM |
511.63 |
CCC(CC)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CNCC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4635564 |
OBDepict
O
HN
O
N
N
NH
HN
N
N
H
|
IC50 |
= |
138.0 |
nM |
509.61 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CNCC3)c1)NC1CCCC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4634012 |
OBDepict
O
HN
O
H
3
C
H
3
C
CH
3
N
N
N
H
N
O
N
N
H
|
IC50 |
= |
155.0 |
nM |
567.69 |
CC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2CCOC2)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4635844 |
OBDepict
O
NH
O
F
F
F
N
N
N
H
O
N
N
H
|
IC50 |
= |
160.0 |
nM |
510.48 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1)NCC(F)(F)F |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780772 |
OBDepict
CH
3
O
N
N
N
N
N
N
O
H
3
C
|
IC50 |
= |
170.0 |
nM |
416.49 |
COc1cccc(-n2ncc3c(N4CCN(c5ccccc5OC)CC4)ncnc32)c1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781625 |
OBDepict
CH
3
O
N
N
N
N
N
N
O
H
3
C
|
IC50 |
= |
170.0 |
nM |
416.49 |
COc1ccc(-n2ncc3c(N4CCN(c5ccccc5OC)CC4)ncnc32)cc1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781183 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
170.0 |
nM |
411.47 |
COc1cc(C#N)ccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4638542 |
OBDepict
H
3
C
O
N
N
N
H
N
O
N
N
N
H
O
H
CH
3
H
3
C
CH
3
|
IC50 |
= |
175.0 |
nM |
555.68 |
COCCN1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4647401 |
OBDepict
O
N
H
O
H
3
C
N
N
N
H
N
N
N
H
|
IC50 |
= |
179.0 |
nM |
549.68 |
CC1(NC(=O)COc2cccc(-c3nc4c(c(Nc5ccc(-c6cn[nH]c6)cc5)n3)CN(C3CCC3)CC4)c2)CC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781194 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
200.0 |
nM |
411.47 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccc(C#N)cc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4645036 |
OBDepict
O
NH
O
CH
3
N
N
N
H
N
N
N
H
|
IC50 |
= |
211.0 |
nM |
535.65 |
CC1(NC(=O)COc2cccc(-c3nc4c(c(Nc5ccc(-c6cn[nH]c6)cc5)n3)CN(C3CC3)CC4)c2)CC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4649311 |
OBDepict
F
N
CH
3
N
N
H
N
O
N
N
N
H
O
H
CH
3
H
3
C
CH
3
|
IC50 |
= |
232.0 |
nM |
557.67 |
CC(CF)N1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4642809 |
OBDepict
CH
3
N
H
CH
3
O
O
N
N
N
H
N
N
N
H
|
IC50 |
= |
238.0 |
nM |
537.67 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2CCC2)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4649021 |
OBDepict
O
NH
O
N
N
NH
O
N
N
H
|
IC50 |
= |
238.0 |
nM |
468.52 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1)NC1CC1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781347 |
OBDepict
CH
3
O
N
N
N
N
N
N
H
3
C
|
IC50 |
= |
250.0 |
nM |
400.49 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2C)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781157 |
OBDepict
CH
3
O
N
N
N
N
N
N
|
IC50 |
= |
250.0 |
nM |
386.46 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4642046 |
OBDepict
H
3
C
O
N
CH
3
N
N
H
N
O
N
N
N
H
O
H
CH
3
H
3
C
CH
3
|
IC50 |
= |
275.0 |
nM |
569.71 |
COCC(C)N1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4632395 |
OBDepict
O
N
H
O
CH
3
H
3
C
CH
3
N
N
N
H
N
N
N
H
|
IC50 |
= |
287.0 |
nM |
551.7 |
CC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2CCC2)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4632920 |
OBDepict
CH
3
N
H
O
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
298.0 |
nM |
470.53 |
CCCNC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781827 |
OBDepict
H
3
C
O
N
N
N
N
N
N
|
IC50 |
= |
320.0 |
nM |
386.46 |
COc1cccc(N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)c1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780470 |
OBDepict
CH
3
O
N
N
N
N
N
N
O
F
CH
3
|
IC50 |
= |
320.0 |
nM |
434.48 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cc(F)ccc2OC)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4649877 |
OBDepict
O
HN
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
325.0 |
nM |
504.55 |
O=C(COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1)Nc1ccccc1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780595 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
O
H
3
C
|
IC50 |
= |
340.0 |
nM |
417.47 |
COc1ccc(-n2ncc3c(N4CCN(c5ccccc5OC)CC4)ncnc32)cn1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780765 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
350.0 |
nM |
411.47 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2cccc(C#N)c2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4637262 |
OBDepict
H
3
C
HN
CH
3
O
O
N
N
N
H
NH
N
N
H
|
IC50 |
= |
365.0 |
nM |
483.58 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CNCC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4638502 |
OBDepict
CH
3
N
N
N
H
N
O
N
N
N
H
O
H
H
3
C
CH
3
H
3
C
|
IC50 |
= |
368.0 |
nM |
511.63 |
CN1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4633530 |
OBDepict
O
N
H
O
N
N
HN
N
H
3
C
N
N
H
|
IC50 |
= |
391.0 |
nM |
523.64 |
CN1CCc2nc(-c3cccc(OCC(=O)NC4CCCC4)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4635864 |
OBDepict
CH
3
NH
H
3
C
H
3
C
O
O
N
N
N
H
N
H
3
C
N
N
H
|
IC50 |
= |
391.0 |
nM |
525.66 |
CCC(C)(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4648189 |
OBDepict
H
3
C
N
H
CH
3
O
O
N
N
N
H
N
H
3
C
N
N
H
|
IC50 |
= |
392.0 |
nM |
537.67 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2(C)CC2)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4648473 |
OBDepict
O
HN
O
CH
3
H
3
C
CH
3
N
N
N
H
N
CH
3
CH
3
N
N
H
|
IC50 |
= |
412.0 |
nM |
539.68 |
CC(C)N1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781384 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
430.0 |
nM |
387.45 |
COc1ccccc1N1CCN(c2ncnc3c2nnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781633 |
OBDepict
CH
3
O
N
N
CH
3
N
N
N
N
|
IC50 |
= |
480.0 |
nM |
400.49 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)C(C)C1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4641999 |
OBDepict
CH
3
N
N
N
H
N
O
N
N
N
H
O
H
CH
3
H
3
C
CH
3
|
IC50 |
= |
482.0 |
nM |
525.66 |
CCN1CCc2nc(-c3cccc(OCC(=O)NC(C)(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3781447 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
540.0 |
nM |
411.47 |
COc1c(C#N)cccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3781994 |
OBDepict
F
N
N
N
N
N
N
|
IC50 |
= |
540.0 |
nM |
374.42 |
Fc1cccc(N2CCN(c3ncnc4c3cnn4-c3ccccc3)CC2)c1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4645662 |
OBDepict
H
3
C
HN
CH
3
O
O
N
N
N
H
N
N
N
H
|
IC50 |
= |
548.0 |
nM |
523.64 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C2CC2)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4638556 |
OBDepict
O
N
H
O
N
N
NH
N
CH
3
CH
3
N
N
H
|
IC50 |
= |
548.0 |
nM |
551.7 |
CC(C)N1CCc2nc(-c3cccc(OCC(=O)NC4CCCC4)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4637311 |
OBDepict
O
HN
O
N
N
N
H
N
CH
3
N
N
H
|
IC50 |
= |
566.0 |
nM |
509.61 |
CN1CCc2nc(-c3cccc(OCC(=O)NC4CCC4)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4647586 |
OBDepict
CH
3
NH
CH
3
O
O
N
N
N
H
N
H
3
C
N
N
H
|
IC50 |
= |
584.0 |
nM |
525.66 |
CCC(CC)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4640792 |
OBDepict
H
3
C
HN
CH
3
O
O
N
N
N
H
N
CH
3
CH
3
N
N
H
|
IC50 |
= |
619.0 |
nM |
525.66 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C(C)C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780054 |
OBDepict
CH
3
O
N
N
N
N
N
N
H
O
|
IC50 |
= |
630.0 |
nM |
402.46 |
COc1ccccc1N1CCN(c2ncnc3c2[nH]c(=O)n3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780459 |
OBDepict
F
N
N
N
N
N
N
|
IC50 |
= |
680.0 |
nM |
374.42 |
Fc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780764 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
680.0 |
nM |
387.45 |
COc1ncccc1N1CCN(c2ncnc3c2cnn3-c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL4645739 |
OBDepict
CH
3
N
O
CH
3
O
N
N
N
H
O
N
N
H
|
IC50 |
= |
686.0 |
nM |
484.56 |
CCN(CC)C(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)COC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4649211 |
OBDepict
CH
3
CH
3
NH
O
O
N
N
N
H
N
H
3
C
CH
3
N
N
H
|
IC50 |
= |
802.0 |
nM |
539.68 |
CC(C)CNC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C(C)C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4649871 |
OBDepict
CH
3
N
N
N
H
N
O
N
N
N
H
O
H
CH
3
CH
3
|
IC50 |
= |
846.0 |
nM |
511.63 |
CCN1CCc2nc(-c3cccc(OCC(=O)NC(C)C)c3)nc(Nc3ccc(-c4cn[nH]c4)cc3)c2C1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4637272 |
OBDepict
H
3
C
CH
3
HN
O
O
N
N
N
H
N
CH
3
N
N
H
|
IC50 |
= |
846.0 |
nM |
511.63 |
CC(C)CNC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL4634395 |
OBDepict
CH
3
N
N
N
H
N
O
N
N
N
H
O
H
H
3
C
CH
3
|
IC50 |
= |
867.0 |
nM |
497.6 |
CC(C)NC(=O)COc1cccc(-c2nc3c(c(Nc4ccc(-c5cn[nH]c5)cc4)n2)CN(C)CC3)c1 |
Homo sapiens |
CHEMBL4605537 |
cell-based format |
CHEMBL3780349 |
OBDepict
CH
3
O
N
N
N
N
N
N
N
|
IC50 |
= |
940.0 |
nM |
387.45 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3-c2ccccn2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |
CHEMBL3780729 |
OBDepict
CH
3
O
N
N
N
N
N
N
CH
3
|
IC50 |
= |
950.0 |
nM |
414.51 |
COc1ccccc1N1CCN(c2ncnc3c2cnn3C(C)c2ccccc2)CC1 |
Homo sapiens |
CHEMBL3782732 |
cell-based format |