molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL336546 |
|
IC50 |
= |
50.0 |
nM |
437.65 |
O=C(Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cnc(Cl)nc1C(F)(F)F |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL131636 |
OBDepict
CH
3
O
O
N
H
F
F
F
O
N
N
F
F
F
Cl
|
IC50 |
= |
120.0 |
nM |
469.77 |
CCCCOC(=O)c1cc(NC(=O)c2cnc(Cl)nc2C(F)(F)F)cc(C(F)(F)F)c1 |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL134490 |
OBDepict
CH
3
O
O
N
H
F
F
F
O
N
N
F
F
F
Cl
|
IC50 |
= |
150.0 |
nM |
441.72 |
CCOC(=O)c1cc(NC(=O)c2cnc(Cl)nc2C(F)(F)F)cc(C(F)(F)F)c1 |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL135133 |
OBDepict
Cl
N
N
F
F
F
N
H
O
F
F
F
|
IC50 |
= |
490.0 |
nM |
369.65 |
O=C(Nc1ccc(C(F)(F)F)cc1)c1cnc(Cl)nc1C(F)(F)F |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL336099 |
OBDepict
Cl
N
N
F
F
F
N
H
O
N
Cl
N
Cl
|
IC50 |
= |
500.0 |
nM |
372.52 |
O=C(Nc1cc(Cl)nc(Cl)n1)c1cnc(Cl)nc1C(F)(F)F |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL334485 |
OBDepict
Cl
N
N
F
F
F
N
H
O
Cl
Cl
|
IC50 |
= |
500.0 |
nM |
370.55 |
O=C(Nc1cc(Cl)cc(Cl)c1)c1cnc(Cl)nc1C(F)(F)F |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL423153 |
OBDepict
CH
3
O
O
N
H
F
F
F
O
N
N
F
F
F
Cl
|
IC50 |
= |
660.0 |
nM |
497.82 |
CCCCCCOC(=O)c1cc(NC(=O)c2cnc(Cl)nc2C(F)(F)F)cc(C(F)(F)F)c1 |
Homo sapiens |
CHEMBL640575 |
cell-based format |
CHEMBL134603 |
OBDepict
Cl
N
N
F
F
F
N
H
O
Cl
Cl
Cl
|
IC50 |
= |
900.0 |
nM |
404.99 |
O=C(Nc1cc(Cl)c(Cl)c(Cl)c1)c1cnc(Cl)nc1C(F)(F)F |
Homo sapiens |
CHEMBL640575 |
cell-based format |