BDBM50452659 CHEMBL304546

SMILES: CN1[C@H](CNC(=O)c2ccc(C)cc2)CN=C(c2ccc(F)cc2)c2ccc(C)cc12

InChI Key: InChIKey=RWJNKNFUNQGDEQ-QFIPXVFZSA-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 = 50452659   

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
Opioid receptor (Rattus norvegicus (rat)-RAT)	BDBM50452659 (CHEMBL304546) Show SMILES CN1[C@H](CNC(=O)c2ccc(C)cc2)CN=C(c2ccc(F)cc2)c2ccc(C)cc12 |t:16| Show InChI InChI=1S/C26H26FN3O/c1-17-4-7-20(8-5-17)26(31)29-16-22-15-28-25(19-9-11-21(27)12-10-19)23-13-6-18(2)14-24(23)30(22)3/h4-14,22H,15-16H2,1-3H3,(H,29,31)/t22-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Evaluated for its concentration required for displacement of [3H]-Naloxone from opioid receptors in rat brain tissues				J Med Chem 33: 450-5 (1990) BindingDB Entry DOI: 10.7270/Q26M35TN
					More data for this Ligand-Target Pair
Cholecystokinin receptor (Homo sapiens (Human))	BDBM50452659 (CHEMBL304546) Show SMILES CN1[C@H](CNC(=O)c2ccc(C)cc2)CN=C(c2ccc(F)cc2)c2ccc(C)cc12 |t:16| Show InChI InChI=1S/C26H26FN3O/c1-17-4-7-20(8-5-17)26(31)29-16-22-15-28-25(19-9-11-21(27)12-10-19)23-13-6-18(2)14-24(23)30(22)3/h4-14,22H,15-16H2,1-3H3,(H,29,31)/t22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-CCK-8 to Cholecystokinin type B receptor in guinea pig brain tissues				J Med Chem 33: 450-5 (1990) BindingDB Entry DOI: 10.7270/Q26M35TN
					More data for this Ligand-Target Pair
Cholecystokinin receptor (RAT)	BDBM50452659 (CHEMBL304546) Show SMILES CN1[C@H](CNC(=O)c2ccc(C)cc2)CN=C(c2ccc(F)cc2)c2ccc(C)cc12 |t:16| Show InChI InChI=1S/C26H26FN3O/c1-17-4-7-20(8-5-17)26(31)29-16-22-15-28-25(19-9-11-21(27)12-10-19)23-13-6-18(2)14-24(23)30(22)3/h4-14,22H,15-16H2,1-3H3,(H,29,31)/t22-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	29	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Research Laboratories Curated by ChEMBL					Assay Description Inhibition of binding of [125I]-CCK-8 to Cholecystokinin type A receptor in rat pancreas				J Med Chem 33: 450-5 (1990) BindingDB Entry DOI: 10.7270/Q26M35TN
					More data for this Ligand-Target Pair