BindingDB logo
myBDB logout

BDBM50019255 2-Chloro-N-methyl-N-(1-methyl-2-oxo-5-phenyl-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl)-benzamide:0.35CHCl3::CHEMBL431185

SMILES: CN(C1N=C(c2ccccc2)c2ccccc2N(C)C1=O)C(=O)c1ccccc1Cl

InChI Key: InChIKey=JHZGBJJYRSJSHT-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50019255   
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
Cholecystokinin receptor


(RAT)
BDBM50019255
PNG
(2-Chloro-N-methyl-N-(1-methyl-2-oxo-5-phenyl-2,3-d...)
Show SMILES CN(C1N=C(c2ccccc2)c2ccccc2N(C)C1=O)C(=O)c1ccccc1Cl
Show InChI InChI=1S/C24H20ClN3O2/c1-27-20-15-9-7-13-18(20)21(16-10-4-3-5-11-16)26-22(24(27)30)28(2)23(29)17-12-6-8-14-19(17)25/h3-15,22H,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 5.80E+4n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]CCK-33 binding to cholecystokinin A receptor from rat pancreatic tissue


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50019255
PNG
(2-Chloro-N-methyl-N-(1-methyl-2-oxo-5-phenyl-2,3-d...)
Show SMILES CN(C1N=C(c2ccccc2)c2ccccc2N(C)C1=O)C(=O)c1ccccc1Cl
Show InChI InChI=1S/C24H20ClN3O2/c1-27-20-15-9-7-13-18(20)21(16-10-4-3-5-11-16)26-22(24(27)30)28(2)23(29)17-12-6-8-14-19(17)25/h3-15,22H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.00E+5n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]-CCK-8(+) binding to cholecystokinin receptor from guinea pig brain tissue


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(Homo sapiens (Human))
BDBM50019255
PNG
(2-Chloro-N-methyl-N-(1-methyl-2-oxo-5-phenyl-2,3-d...)
Show SMILES CN(C1N=C(c2ccccc2)c2ccccc2N(C)C1=O)C(=O)c1ccccc1Cl
Show InChI InChI=1S/C24H20ClN3O2/c1-27-20-15-9-7-13-18(20)21(16-10-4-3-5-11-16)26-22(24(27)30)28(2)23(29)17-12-6-8-14-19(17)25/h3-15,22H,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Half-maximal inhibition of [125I]gastrin binding to guinea pig gastric glands


J Med Chem 31: 2235-46 (1989)


Article DOI: 10.1021/jm00120a002
BindingDB Entry DOI: 10.7270/Q2PG1S9K
More data for this
Ligand-Target Pair