BDBM50032405 3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-methano-benzo[d]azocine::CHEMBL101607

SMILES: CC1C2Cc3ccccc3C1(C)CCN2Cc1ccccc1

InChI Key: InChIKey=QAAXWTHVNTVMCJ-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50032405   

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))	BDBM50032405 (3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-m...) Show SMILES CC1C2Cc3ccccc3C1(C)CCN2Cc1ccccc1 |TLB:15:14:1:9.3.4,8:9:1:14.12.13| Show InChI InChI=1S/C21H25N/c1-16-20-14-18-10-6-7-11-19(18)21(16,2)12-13-22(20)15-17-8-4-3-5-9-17/h3-11,16,20H,12-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	59	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 measured on Sigma receptor type 1 from guinea pig brain membranes using [3H]pentazocine as radioligand.				J Med Chem 38: 2978-85 (1995) BindingDB Entry DOI: 10.7270/Q2V988RP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (Homo sapiens (Human))	BDBM50032405 (3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-m...) Show SMILES CC1C2Cc3ccccc3C1(C)CCN2Cc1ccccc1 |TLB:15:14:1:9.3.4,8:9:1:14.12.13| Show InChI InChI=1S/C21H25N/c1-16-20-14-18-10-6-7-11-19(18)21(16,2)12-13-22(20)15-17-8-4-3-5-9-17/h3-11,16,20H,12-15H2,1-2H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	59	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 measured on Sigma receptor type 1 from guinea pig brain membranes using [3H]pentazocine as radioligand.				J Med Chem 38: 2978-85 (1995) BindingDB Entry DOI: 10.7270/Q2V988RP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50032405 (3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-m...) Show SMILES CC1C2Cc3ccccc3C1(C)CCN2Cc1ccccc1 |TLB:15:14:1:9.3.4,8:9:1:14.12.13| Show InChI InChI=1S/C21H25N/c1-16-20-14-18-10-6-7-11-19(18)21(16,2)12-13-22(20)15-17-8-4-3-5-9-17/h3-11,16,20H,12-15H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	230	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 2 on rat liver membranes receptor by [3H]DTG displacement.				J Med Chem 38: 2978-85 (1995) BindingDB Entry DOI: 10.7270/Q2V988RP
					More data for this Ligand-Target Pair
Sigma non-opioid intracellular receptor 1 (RAT)	BDBM50032405 (3-Benzyl-6,11-dimethyl-1,2,3,4,5,6-hexahydro-2,6-m...) Show SMILES CC1C2Cc3ccccc3C1(C)CCN2Cc1ccccc1 |TLB:15:14:1:9.3.4,8:9:1:14.12.13| Show InChI InChI=1S/C21H25N/c1-16-20-14-18-10-6-7-11-19(18)21(16,2)12-13-22(20)15-17-8-4-3-5-9-17/h3-11,16,20H,12-15H2,1-2H3	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	230	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 2 on rat liver membranes receptor by [3H]DTG displacement.				J Med Chem 38: 2978-85 (1995) BindingDB Entry DOI: 10.7270/Q2V988RP
					More data for this Ligand-Target Pair