molecule_chembl_id |
structure |
assay_type |
relation |
values |
units |
mol_wt |
smiles |
organism |
assay_chembl_id |
bao_label |
CHEMBL3314362 |
|
IC50 |
= |
40.0 |
nM |
395.93 |
Cc1cc2c(cc1CN(C)C)CCN(C(=O)c1cc3cc(Cl)ccc3n1C)C2 |
Homo sapiens |
CHEMBL3368109 |
cell-based format |
CHEMBL3314349 |
OBDepict
H
3
C
N
CH
3
N
O
N
H
3
C
Cl
|
IC50 |
= |
70.0 |
nM |
381.91 |
CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ccc3n1C)C2 |
Homo sapiens |
CHEMBL3368109 |
cell-based format |
CHEMBL3314358 |
OBDepict
H
3
C
N
CH
3
CH
3
N
O
N
H
3
C
N
Br
|
IC50 |
= |
110.0 |
nM |
441.37 |
CC1CN(C(=O)c2cc3cc(Br)ncc3n2C)Cc2ccc(CN(C)C)cc21 |
Homo sapiens |
CHEMBL3368108 |
cell-based format |
CHEMBL3314354 |
OBDepict
H
3
C
N
CH
3
N
O
N
H
3
C
N
I
|
IC50 |
= |
130.0 |
nM |
474.35 |
CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3cc(I)ncc3n1C)C2 |
Homo sapiens |
CHEMBL3368108 |
cell-based format |
CHEMBL3314352 |
OBDepict
H
3
C
N
CH
3
N
O
N
H
3
C
N
Br
|
IC50 |
= |
280.0 |
nM |
427.35 |
CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3cc(Br)ncc3n1C)C2 |
Homo sapiens |
CHEMBL3368109 |
cell-based format |
CHEMBL3314361 |
OBDepict
CH
3
N
H
3
C
H
3
C
N
O
N
CH
3
N
Cl
|
IC50 |
= |
460.0 |
nM |
396.92 |
CC(c1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ncc3n1C)C2)N(C)C |
Homo sapiens |
CHEMBL3368108 |
cell-based format |
CHEMBL3314359 |
OBDepict
H
3
C
N
CH
3
H
3
C
N
O
N
H
3
C
N
Cl
|
IC50 |
= |
500.0 |
nM |
396.92 |
CC1c2ccc(CN(C)C)cc2CCN1C(=O)c1cc2cc(Cl)ncc2n1C |
Homo sapiens |
CHEMBL3368108 |
cell-based format |
CHEMBL3314350 |
OBDepict
H
3
C
N
CH
3
N
O
N
H
3
C
N
Cl
|
IC50 |
= |
570.0 |
nM |
382.9 |
CN(C)Cc1ccc2c(c1)CCN(C(=O)c1cc3cc(Cl)ncc3n1C)C2 |
Homo sapiens |
CHEMBL3368108 |
cell-based format |
CHEMBL3314360 |
OBDepict
CH
3
N
H
3
C
N
CH
3
O
N
CH
3
N
Cl
|
IC50 |
= |
710.0 |
nM |
396.92 |
CC1Cc2cc(CN(C)C)ccc2CN1C(=O)c1cc2cc(Cl)ncc2n1C |
Homo sapiens |
CHEMBL3368108 |
cell-based format |