BDBM50478163 CHEMBL410706

SMILES: COc1ccc(C)c(OC(CCN2CCC(CC2)n2c3ccccc3n(Cc3cc(C)on3)c2=O)C(C)C)c1

InChI Key: InChIKey=IDLRMEJDJHCABK-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 = 50478163   

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
Nociceptin receptor (Homo sapiens (Human))	BDBM50478163 (CHEMBL410706) Show SMILES COc1ccc(C)c(OC(CCN2CCC(CC2)n2c3ccccc3n(Cc3cc(C)on3)c2=O)C(C)C)c1 Show InChI InChI=1S/C31H40N4O4/c1-21(2)29(38-30-19-26(37-5)11-10-22(30)3)14-17-33-15-12-25(13-16-33)35-28-9-7-6-8-27(28)34(31(35)36)20-24-18-23(4)39-32-24/h6-11,18-19,21,25,29H,12-17,20H2,1-5H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	22	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd Curated by ChEMBL					Assay Description Displacement of [3H]nociceptin from human NOP receptor expressed in CHO cells				Bioorg Med Chem 16: 2829-51 (2008) Article DOI: 10.1016/j.bmc.2008.01.005 BindingDB Entry DOI: 10.7270/Q2C82D2D
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM50478163 (CHEMBL410706) Show SMILES COc1ccc(C)c(OC(CCN2CCC(CC2)n2c3ccccc3n(Cc3cc(C)on3)c2=O)C(C)C)c1 Show InChI InChI=1S/C31H40N4O4/c1-21(2)29(38-30-19-26(37-5)11-10-22(30)3)14-17-33-15-12-25(13-16-33)35-28-9-7-6-8-27(28)34(31(35)36)20-24-18-23(4)39-32-24/h6-11,18-19,21,25,29H,12-17,20H2,1-5H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	145	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd Curated by ChEMBL					Assay Description Displacement of [3H]Diprenorphine from human mu opioid receptor expressed in CHO cells				Bioorg Med Chem 16: 2829-51 (2008) Article DOI: 10.1016/j.bmc.2008.01.005 BindingDB Entry DOI: 10.7270/Q2C82D2D
					More data for this Ligand-Target Pair