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BDBM50019234 3-[5-(2-Fluoro-phenyl)-2-oxo-2,3-dihydro-1H-benzo[e][1,4]diazepin-3-yl]-1-methyl-1-phenyl-urea: 0.55CHCl3::CHEMBL306958

SMILES: CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1

InChI Key: InChIKey=BCAYFVWDGNYAJC-UHFFFAOYNA-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 = 50019234   
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)
BDBM50019234
PNG
(3-[5-(2-Fluoro-phenyl)-2-oxo-2,3-dihydro-1H-benzo[...)
Show SMILES CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1
Show InChI InChI=1/C23H19FN4O2/c1-28(15-9-3-2-4-10-15)23(30)27-21-22(29)25-19-14-8-6-12-17(19)20(26-21)16-11-5-7-13-18(16)24/h2-14,21H,1H3,(H,25,29)(H,27,30)
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UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 900n/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))
BDBM50019234
PNG
(3-[5-(2-Fluoro-phenyl)-2-oxo-2,3-dihydro-1H-benzo[...)
Show SMILES CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1
Show InChI InChI=1/C23H19FN4O2/c1-28(15-9-3-2-4-10-15)23(30)27-21-22(29)25-19-14-8-6-12-17(19)20(26-21)16-11-5-7-13-18(16)24/h2-14,21H,1H3,(H,25,29)(H,27,30)
PDB
MMDB

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B.MOAD
DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

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))
BDBM50019234
PNG
(3-[5-(2-Fluoro-phenyl)-2-oxo-2,3-dihydro-1H-benzo[...)
Show SMILES CN(C(=O)NC1N=C(c2ccccc2F)c2ccccc2NC1=O)c1ccccc1
Show InChI InChI=1/C23H19FN4O2/c1-28(15-9-3-2-4-10-15)23(30)27-21-22(29)25-19-14-8-6-12-17(19)20(26-21)16-11-5-7-13-18(16)24/h2-14,21H,1H3,(H,25,29)(H,27,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/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