molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3289424 |
|
IC50 |
= |
40.0 |
nM |
374.44 |
CC(CNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12)N(C)C |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289398 |
OBDepict
CH
3
N
H
3
C
N
H
O
N
N
O
|
IC50 |
= |
50.0 |
nM |
360.42 |
CN(C)CCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289421 |
OBDepict
O
N
H
N
N
N
O
|
IC50 |
= |
90.0 |
nM |
386.46 |
O=C(NCCN1CCCC1)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289423 |
OBDepict
CH
3
N
CH
3
NH
H
3
C
O
N
N
O
|
IC50 |
= |
110.0 |
nM |
374.44 |
CC(CN(C)C)NC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289422 |
OBDepict
CH
3
N
CH
3
N
H
O
N
N
O
|
IC50 |
= |
140.0 |
nM |
388.47 |
CCN(CC)CCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289414 |
OBDepict
H
3
C
N
NH
O
N
N
O
|
IC50 |
= |
180.0 |
nM |
386.46 |
CN1CCC(NC(=O)c2cccn3c(=O)c4cc5ccccc5cc4nc23)CC1 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289420 |
OBDepict
O
N
H
N
N
N
O
|
IC50 |
= |
180.0 |
nM |
400.48 |
O=C(NCCN1CCCCC1)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289413 |
OBDepict
O
N
H
N
N
N
H
O
|
IC50 |
= |
210.0 |
nM |
344.37 |
O=C(NC1CNC1)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289410 |
OBDepict
CH
3
N
H
3
C
NH
O
N
N
O
|
IC50 |
= |
430.0 |
nM |
374.44 |
CN(C)CCCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289409 |
OBDepict
H
3
C
N
CH
3
N
H
O
N
N
O
|
IC50 |
= |
660.0 |
nM |
388.47 |
CN(C)CCCCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289428 |
OBDepict
CH
3
O
N
CH
3
N
H
O
N
N
O
|
IC50 |
= |
730.0 |
nM |
404.47 |
COCCN(C)CCNC(=O)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |
CHEMBL3289403 |
OBDepict
O
N
H
N
N
N
O
N
|
IC50 |
= |
980.0 |
nM |
383.41 |
O=C(NCCn1ccnc1)c1cccn2c(=O)c3cc4ccccc4cc3nc12 |
Homo sapiens |
CHEMBL3291669 |
cell-based format |