BDBM50321030 CHEMBL1163924::N-{[(1R,9R,10S,13R)-17-(cyclopropylmethyl)-4,10-dihydroxy-12-oxa-17-azatetracyclo[7.5.3.0^{1,10}.0^{2,7}]heptadeca-2,4,6-trien-13-yl]methyl}benzamide
SMILES: Oc1ccc2C[C@H]3N(CC4CC4)CC[C@@]4(C[C@H](CNC(=O)c5ccccc5)OC[C@@]34O)c2c1
InChI Key: InChIKey=YDMZTSLBJFINAW-MDVLPONGSA-N
Data: 1 KI
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)) | BDBM50321030 (CHEMBL1163924 | N-{[(1R,9R,10S,13R)-17-(cyclopropy...) | PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 0.135 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kitasato University Curated by ChEMBL | Assay Description Binding affinity to kappa opioid receptor | Bioorg Med Chem 18: 4446-52 (2010) Article DOI: 10.1016/j.bmc.2010.04.069 BindingDB Entry DOI: 10.7270/Q23X87MV | |||||||||||
More data for this Ligand-Target Pair |