BDBM50001853 2-Amino-N-(2-fluoro-1-methyl-6-phenyl-hex-2-enyl)-3-(4-hydroxy-2,6-dimethyl-phenyl)-propionamide::CHEMBL76062

SMILES: CC(NC(=O)C(N)Cc1c(C)cc(O)cc1C)C(\F)=C\CCCc1ccccc1

InChI Key: InChIKey=GCMXFAGNVBGNHO-UUYOSTAYSA-N

Data: 2 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 2 hits for monomerid = 50001853   

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
Kappa-type opioid receptor (Rattus norvegicus (rat))	BDBM50001853 (2-Amino-N-(2-fluoro-1-methyl-6-phenyl-hex-2-enyl)-...) Show SMILES CC(NC(=O)C(N)Cc1c(C)cc(O)cc1C)C(\F)=C\CCCc1ccccc1 Show InChI InChI=1S/C24H31FN2O2/c1-16-13-20(28)14-17(2)21(16)15-23(26)24(29)27-18(3)22(25)12-8-7-11-19-9-5-4-6-10-19/h4-6,9-10,12-14,18,23,28H,7-8,11,15,26H2,1-3H3,(H,27,29)/b22-12-	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle and Company Curated by ChEMBL					Assay Description Binding ability towards opioid receptor kappa expressed in homogenates of rat brain.				J Med Chem 35: 223-33 (1992) BindingDB Entry DOI: 10.7270/Q26T0KKD
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50001853 (2-Amino-N-(2-fluoro-1-methyl-6-phenyl-hex-2-enyl)-...) Show SMILES CC(NC(=O)C(N)Cc1c(C)cc(O)cc1C)C(\F)=C\CCCc1ccccc1 Show InChI InChI=1S/C24H31FN2O2/c1-16-13-20(28)14-17(2)21(16)15-23(26)24(29)27-18(3)22(25)12-8-7-11-19-9-5-4-6-10-19/h4-6,9-10,12-14,18,23,28H,7-8,11,15,26H2,1-3H3,(H,27,29)/b22-12-	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	6.90	n/a	n/a	n/a	n/a	n/a	n/a
G. D. Searle and Company Curated by ChEMBL					Assay Description Binding ability towards opioid receptor mu expressed in homogenates of rat brain.				J Med Chem 35: 223-33 (1992) BindingDB Entry DOI: 10.7270/Q26T0KKD
					More data for this Ligand-Target Pair