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BDBM50286434 1-(2-Chloro-4-hydroxy-phenyl)-4-oxo-7-pyridin-4-yl-1,4-dihydro-quinoline-3-carboxylic acid amide::CHEMBL340384

SMILES: NC(=O)c1cn(-c2ccc(O)cc2Cl)c2cc(ccc2c1=O)-c1ccncc1

InChI Key: InChIKey=CLRFYTGANQZOBS-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50286434   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Procathepsin L


(Homo sapiens (Human))
BDBM50286434
PNG
(1-(2-Chloro-4-hydroxy-phenyl)-4-oxo-7-pyridin-4-yl...)
Show SMILES NC(=O)c1cn(-c2ccc(O)cc2Cl)c2cc(ccc2c1=O)-c1ccncc1
Show InChI InChI=1S/C21H14ClN3O3/c22-17-10-14(26)2-4-18(17)25-11-16(21(23)28)20(27)15-3-1-13(9-19(15)25)12-5-7-24-8-6-12/h1-11,26H,(H2,23,28)
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Article
n/an/a 2.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against cathepsin L


Bioorg Med Chem Lett 5: 387-392 (1995)


Article DOI: 10.1016/0960-894X(95)00041-Q
BindingDB Entry DOI: 10.7270/Q21G0M6W
More data for this
Ligand-Target Pair
Calpain1


(Homo sapiens (Human))
BDBM50286434
PNG
(1-(2-Chloro-4-hydroxy-phenyl)-4-oxo-7-pyridin-4-yl...)
Show SMILES NC(=O)c1cn(-c2ccc(O)cc2Cl)c2cc(ccc2c1=O)-c1ccncc1
Show InChI InChI=1S/C21H14ClN3O3/c22-17-10-14(26)2-4-18(17)25-11-16(21(23)28)20(27)15-3-1-13(9-19(15)25)12-5-7-24-8-6-12/h1-11,26H,(H2,23,28)
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Article
n/an/a 600n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human erythrocyte Calpain 1


Bioorg Med Chem Lett 5: 387-392 (1995)


Article DOI: 10.1016/0960-894X(95)00041-Q
BindingDB Entry DOI: 10.7270/Q21G0M6W
More data for this
Ligand-Target Pair
Cathepsin B


(Homo sapiens (Human))
BDBM50286434
PNG
(1-(2-Chloro-4-hydroxy-phenyl)-4-oxo-7-pyridin-4-yl...)
Show SMILES NC(=O)c1cn(-c2ccc(O)cc2Cl)c2cc(ccc2c1=O)-c1ccncc1
Show InChI InChI=1S/C21H14ClN3O3/c22-17-10-14(26)2-4-18(17)25-11-16(21(23)28)20(27)15-3-1-13(9-19(15)25)12-5-7-24-8-6-12/h1-11,26H,(H2,23,28)
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Article
n/an/a 2.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against Cathepsin B


Bioorg Med Chem Lett 5: 387-392 (1995)


Article DOI: 10.1016/0960-894X(95)00041-Q
BindingDB Entry DOI: 10.7270/Q21G0M6W
More data for this
Ligand-Target Pair
Calpain1


(Homo sapiens (Human))
BDBM50286434
PNG
(1-(2-Chloro-4-hydroxy-phenyl)-4-oxo-7-pyridin-4-yl...)
Show SMILES NC(=O)c1cn(-c2ccc(O)cc2Cl)c2cc(ccc2c1=O)-c1ccncc1
Show InChI InChI=1S/C21H14ClN3O3/c22-17-10-14(26)2-4-18(17)25-11-16(21(23)28)20(27)15-3-1-13(9-19(15)25)12-5-7-24-8-6-12/h1-11,26H,(H2,23,28)
PDB
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Reactome pathway
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PC sid
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Article
n/an/a 500n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against human erythrocyte Calpain 1


Bioorg Med Chem Lett 5: 387-392 (1995)


Article DOI: 10.1016/0960-894X(95)00041-Q
BindingDB Entry DOI: 10.7270/Q21G0M6W
More data for this
Ligand-Target Pair