BDBM50086358 CHEMBL347316::N-Cyclopropylmethyl-3-(3-hydroxy-phenyl)-2,2-dimethyl-3-methylamino-propionamide

SMILES: CNC(c1cccc(O)c1)C(C)(C)C(=O)NCC1CC1

InChI Key: InChIKey=GSESOVPOIJJEIO-UHFFFAOYSA-N

Data: 3 KI

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 = 50086358   

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 (Homo sapiens (Human))	BDBM50086358 (CHEMBL347316 | N-Cyclopropylmethyl-3-(3-hydroxy-ph...) Show SMILES CNC(c1cccc(O)c1)C(C)(C)C(=O)NCC1CC1 Show InChI InChI=1S/C16H24N2O2/c1-16(2,15(20)18-10-11-7-8-11)14(17-3)12-5-4-6-13(19)9-12/h4-6,9,11,14,17,19H,7-8,10H2,1-3H3,(H,18,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	75	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc Curated by ChEMBL					Assay Description Inhibition of [3H]U-69,593 binding to human Opioid receptor kappa 1 expressed in HEK 293 cells				Bioorg Med Chem Lett 10: 523-6 (2000) BindingDB Entry DOI: 10.7270/Q2BG2N79
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Rattus norvegicus (rat))	BDBM50086358 (CHEMBL347316 | N-Cyclopropylmethyl-3-(3-hydroxy-ph...) Show SMILES CNC(c1cccc(O)c1)C(C)(C)C(=O)NCC1CC1 Show InChI InChI=1S/C16H24N2O2/c1-16(2,15(20)18-10-11-7-8-11)14(17-3)12-5-4-6-13(19)9-12/h4-6,9,11,14,17,19H,7-8,10H2,1-3H3,(H,18,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	364	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc Curated by ChEMBL					Assay Description Inhibition of [3H]-DAMGO binding to rat Opioid receptor mu 1				Bioorg Med Chem Lett 10: 523-6 (2000) BindingDB Entry DOI: 10.7270/Q2BG2N79
					More data for this Ligand-Target Pair
Delta-type opioid receptor (Homo sapiens (Human))	BDBM50086358 (CHEMBL347316 | N-Cyclopropylmethyl-3-(3-hydroxy-ph...) Show SMILES CNC(c1cccc(O)c1)C(C)(C)C(=O)NCC1CC1 Show InChI InChI=1S/C16H24N2O2/c1-16(2,15(20)18-10-11-7-8-11)14(17-3)12-5-4-6-13(19)9-12/h4-6,9,11,14,17,19H,7-8,10H2,1-3H3,(H,18,20)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	781	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc Curated by ChEMBL					Assay Description Inhibition of [3H]-naltrindole binding to human Opioid receptor delta 1 in CHO cells				Bioorg Med Chem Lett 10: 523-6 (2000) BindingDB Entry DOI: 10.7270/Q2BG2N79
					More data for this Ligand-Target Pair