BDBM50367625 CHEMBL1907845

SMILES: CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccccc2I)C1=O)c1ccccc1F

InChI Key: InChIKey=NFWIPCKQRRCBGC-NRFANRHFSA-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 = 50367625   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Cholecystokinin receptor (Homo sapiens (Human))	BDBM50367625 (CHEMBL1907845) Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccccc2I)C1=O)c1ccccc1F |r,c:9| Show InChI InChI=1S/C23H17FIN3O2/c1-28-19-13-7-4-10-16(19)20(14-8-2-5-11-17(14)24)26-21(23(28)30)27-22(29)15-9-3-6-12-18(15)25/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/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) BindingDB Entry DOI: 10.7270/Q2PG1S9K
					More data for this Ligand-Target Pair
Cholecystokinin receptor (Homo sapiens (Human))	BDBM50367625 (CHEMBL1907845) Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccccc2I)C1=O)c1ccccc1F |r,c:9| Show InChI InChI=1S/C23H17FIN3O2/c1-28-19-13-7-4-10-16(19)20(14-8-2-5-11-17(14)24)26-21(23(28)30)27-22(29)15-9-3-6-12-18(15)25/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a	n/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) BindingDB Entry DOI: 10.7270/Q2PG1S9K
					More data for this Ligand-Target Pair
Cholecystokinin receptor (RAT)	BDBM50367625 (CHEMBL1907845) Show SMILES CN1c2ccccc2C(=N[C@@H](NC(=O)c2ccccc2I)C1=O)c1ccccc1F |r,c:9| Show InChI InChI=1S/C23H17FIN3O2/c1-28-19-13-7-4-10-16(19)20(14-8-2-5-11-17(14)24)26-21(23(28)30)27-22(29)15-9-3-6-12-18(15)25/h2-13,21H,1H3,(H,27,29)/t21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/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) BindingDB Entry DOI: 10.7270/Q2PG1S9K
					More data for this Ligand-Target Pair