BDBM50036241 (2S,6S,11S)-6,11-Dimethyl-3-(4-methyl-benzyl)-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocin-8-ol::CHEMBL157390

SMILES: C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@@]1(C)CCN2Cc1ccc(C)cc1

InChI Key: InChIKey=JTILOIPWOQLSIM-XGRCMKMKSA-N

Data: 1 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 1 hit for monomerid = 50036241   

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
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50036241 ((2S,6S,11S)-6,11-Dimethyl-3-(4-methyl-benzyl)-1,2,...) Show SMILES C[C@@H]1[C@@H]2Cc3ccc(O)cc3[C@@]1(C)CCN2Cc1ccc(C)cc1 |TLB:16:15:1:10.4.3| Show InChI InChI=1S/C22H27NO/c1-15-4-6-17(7-5-15)14-23-11-10-22(3)16(2)21(23)12-18-8-9-19(24)13-20(18)22/h4-9,13,16,21,24H,10-12,14H2,1-3H3/t16-,21+,22+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	2.08	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Research Triangle Institute Curated by ChEMBL					Assay Description Binding affinity at Sigma receptor type 1, displacement of [3H]-(+)-pentazocine from guinea pig brain membranes				J Med Chem 38: 565-9 (1995) BindingDB Entry DOI: 10.7270/Q2X63M0N
					More data for this Ligand-Target Pair