BDBM50100992 CHEMBL3325880

SMILES: Cl.CN(C)C1(CCC(CC1)NC(=O)Cc1ccccc1)c1ccccc1

InChI Key: InChIKey=KLHBMWOJGJDJTL-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50100992   

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
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50100992 (CHEMBL3325880) Show SMILES Cl.CN(C)C1(CCC(CC1)NC(=O)Cc1ccccc1)c1ccccc1 |(14.24,-12.21,;18.31,-7.93,;16.97,-7.16,;16.97,-5.62,;15.64,-7.94,;14.87,-6.61,;13.32,-6.61,;12.56,-7.94,;13.33,-9.27,;14.87,-9.27,;11.02,-7.95,;10.26,-9.28,;11.04,-10.61,;8.72,-9.29,;7.96,-10.63,;6.42,-10.63,;5.66,-11.97,;6.44,-13.3,;7.98,-13.29,;8.74,-11.95,;16.44,-9.26,;15.69,-10.6,;16.49,-11.92,;18.03,-11.89,;18.77,-10.53,;17.97,-9.22,)| Show InChI InChI=1S/C22H28N2O.ClH/c1-24(2)22(19-11-7-4-8-12-19)15-13-20(14-16-22)23-21(25)17-18-9-5-3-6-10-18;/h3-12,20H,13-17H2,1-2H3,(H,23,25);1H	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacokinetics Curated by ChEMBL					Assay Description Displacement of [3H]Naloxone from human mu opioid receptor receptor expressed in CHO-K1 cells after 90 mins				ACS Med Chem Lett 5: 851-6 (2014) Article DOI: 10.1021/ml500116x BindingDB Entry DOI: 10.7270/Q28S4RPM
					More data for this Ligand-Target Pair
Nociceptin receptor (Homo sapiens (Human))	BDBM50100992 (CHEMBL3325880) Show SMILES Cl.CN(C)C1(CCC(CC1)NC(=O)Cc1ccccc1)c1ccccc1 |(14.24,-12.21,;18.31,-7.93,;16.97,-7.16,;16.97,-5.62,;15.64,-7.94,;14.87,-6.61,;13.32,-6.61,;12.56,-7.94,;13.33,-9.27,;14.87,-9.27,;11.02,-7.95,;10.26,-9.28,;11.04,-10.61,;8.72,-9.29,;7.96,-10.63,;6.42,-10.63,;5.66,-11.97,;6.44,-13.3,;7.98,-13.29,;8.74,-11.95,;16.44,-9.26,;15.69,-10.6,;16.49,-11.92,;18.03,-11.89,;18.77,-10.53,;17.97,-9.22,)| Show InChI InChI=1S/C22H28N2O.ClH/c1-24(2)22(19-11-7-4-8-12-19)15-13-20(14-16-22)23-21(25)17-18-9-5-3-6-10-18;/h3-12,20H,13-17H2,1-2H3,(H,23,25);1H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	5.40	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pharmacokinetics Curated by ChEMBL					Assay Description Displacement of [3H]nociceptin from human NOP receptor expressed in CHO-K1 cells after 90 mins				ACS Med Chem Lett 5: 851-6 (2014) Article DOI: 10.1021/ml500116x BindingDB Entry DOI: 10.7270/Q28S4RPM
					More data for this Ligand-Target Pair