BDBM50159898 1-{1-[4-Methyl-3-(2-methyl-5-nitro-phenoxy)-pentyl]-piperidin-4-yl}-1,3-dihydro-benzoimidazol-2-one::CHEMBL180499

SMILES: CC(C)C(CCN1CCC(CC1)n1[c-]2ccccc2nc1=[OH+])Oc1cc(ccc1C)[N+]([O-])=O

InChI Key: InChIKey=BDLXCVFPACECOZ-UHFFFAOYSA-O

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 = 50159898   

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))	BDBM50159898 (1-{1-[4-Methyl-3-(2-methyl-5-nitro-phenoxy)-pentyl...) Show SMILES CC(C)C(CCN1CCC(CC1)n1[c-]2ccccc2nc1=[OH+])Oc1cc(ccc1C)[N+]([O-])=O Show InChI InChI=1S/C25H31N4O4/c1-17(2)23(33-24-16-20(29(31)32)9-8-18(24)3)12-15-27-13-10-19(11-14-27)28-22-7-5-4-6-21(22)26-25(28)30/h4-9,16-17,19,23H,10-15H2,1-3H3/q-1/p+1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	196	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd Curated by ChEMBL					Assay Description Binding affinity towards human opioid receptor mu 1 was determined by using [3H]-diprenorphine as radioligand expressed in Chinese hamster ovary (CHO...				Bioorg Med Chem Lett 15: 589-93 (2005) Article DOI: 10.1016/j.bmcl.2004.11.049 BindingDB Entry DOI: 10.7270/Q2K35T50
					More data for this Ligand-Target Pair
Nociceptin receptor (Homo sapiens (Human))	BDBM50159898 (1-{1-[4-Methyl-3-(2-methyl-5-nitro-phenoxy)-pentyl...) Show SMILES CC(C)C(CCN1CCC(CC1)n1[c-]2ccccc2nc1=[OH+])Oc1cc(ccc1C)[N+]([O-])=O Show InChI InChI=1S/C25H31N4O4/c1-17(2)23(33-24-16-20(29(31)32)9-8-18(24)3)12-15-27-13-10-19(11-14-27)28-22-7-5-4-6-21(22)26-25(28)30/h4-9,16-17,19,23H,10-15H2,1-3H3/q-1/p+1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	218	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Organon Laboratories Ltd Curated by ChEMBL					Assay Description Binding affinity towards human opioid receptor like 1 was determined by using [3H]-nociceptin as radioligand expressed in Chinese hamster ovary (CHO)...				Bioorg Med Chem Lett 15: 589-93 (2005) Article DOI: 10.1016/j.bmcl.2004.11.049 BindingDB Entry DOI: 10.7270/Q2K35T50
					More data for this Ligand-Target Pair