BDBM50244275 1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-4-yl]methyl}-3H-spiro[2-benzofuran-1,4'-piperidine]::CHEMBL470951

SMILES: Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C

InChI Key: InChIKey=SLRRKIAIUARVQX-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50244275   

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))	BDBM50244275 (1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...) Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]diprenorphin from human cloned mu opioid receptor expressed in CHO cells				Bioorg Med Chem Lett 18: 3778-82 (2008) Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50244275 (1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...) Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [35S]MK499 from human ERG in HEK293 cell membrane				Bioorg Med Chem Lett 18: 3778-82 (2008) Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM50244275 (1'-{[3-methyl-1-(3-methylpyridin-2-yl)-1H-pyrazol-...) Show SMILES Cc1nn(cc1CN1CCC2(CC1)OCc1ccccc21)-c1ncccc1C Show InChI InChI=1S/C23H26N4O/c1-17-6-5-11-24-22(17)27-15-20(18(2)25-27)14-26-12-9-23(10-13-26)21-8-4-3-7-19(21)16-28-23/h3-8,11,15H,9-10,12-14,16H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Tsukuba Research Institute Curated by ChEMBL					Assay Description Displacement of [3H]U69593 from human cloned kappa opioid receptor expressed in CHO cells				Bioorg Med Chem Lett 18: 3778-82 (2008) Article DOI: 10.1016/j.bmcl.2008.05.036 BindingDB Entry DOI: 10.7270/Q2XD11G6
					More data for this Ligand-Target Pair