BDBM50359604 CHEMBL1927882

SMILES: Cc1ccc(CN2[C@H]3CC[C@@H]2C\C(C3)=C/COC(c2ccccc2)c2ccccc2)cc1

InChI Key: InChIKey=WVEYUPYUQAKVOQ-LSSKAUEESA-N

Data: 3 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 3 hits for monomerid = 50359604   

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
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50359604 (CHEMBL1927882) Show SMILES Cc1ccc(CN2[C@H]3CC[C@@H]2C\C(C3)=C/COC(c2ccccc2)c2ccccc2)cc1 |r,THB:5:6:13.12.11:9.8| Show InChI InChI=1S/C30H33NO/c1-23-12-14-24(15-13-23)22-31-28-16-17-29(31)21-25(20-28)18-19-32-30(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-15,18,28-30H,16-17,19-22H2,1H3/b25-18-/t28-,29+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	13	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]WIN35428 from DAT in Sprague-Dawley rat brain homogenates after 1 hr by scintillation counting				Bioorg Med Chem 19: 7551-8 (2011) Article DOI: 10.1016/j.bmc.2011.10.028 BindingDB Entry DOI: 10.7270/Q2XP75CJ
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM50359604 (CHEMBL1927882) Show SMILES Cc1ccc(CN2[C@H]3CC[C@@H]2C\C(C3)=C/COC(c2ccccc2)c2ccccc2)cc1 |r,THB:5:6:13.12.11:9.8| Show InChI InChI=1S/C30H33NO/c1-23-12-14-24(15-13-23)22-31-28-16-17-29(31)21-25(20-28)18-19-32-30(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-15,18,28-30H,16-17,19-22H2,1H3/b25-18-/t28-,29+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	746	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]citalopram from SERT in Sprague-Dawley rat brain homogenates after 60 mins by liquid scintillation counting				Bioorg Med Chem 19: 7551-8 (2011) Article DOI: 10.1016/j.bmc.2011.10.028 BindingDB Entry DOI: 10.7270/Q2XP75CJ
					More data for this Ligand-Target Pair
Transporter (Rattus norvegicus (rat))	BDBM50359604 (CHEMBL1927882) Show SMILES Cc1ccc(CN2[C@H]3CC[C@@H]2C\C(C3)=C/COC(c2ccccc2)c2ccccc2)cc1 |r,THB:5:6:13.12.11:9.8| Show InChI InChI=1S/C30H33NO/c1-23-12-14-24(15-13-23)22-31-28-16-17-29(31)21-25(20-28)18-19-32-30(26-8-4-2-5-9-26)27-10-6-3-7-11-27/h2-15,18,28-30H,16-17,19-22H2,1H3/b25-18-/t28-,29+/m0/s1	Reactome pathway UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.77E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
University of New Orleans Curated by ChEMBL					Assay Description Displacement of [3H]nisoxetine from NET in Sprague-Dawley rat brain cortex membranes after 1 hr				Bioorg Med Chem 19: 7551-8 (2011) Article DOI: 10.1016/j.bmc.2011.10.028 BindingDB Entry DOI: 10.7270/Q2XP75CJ
					More data for this Ligand-Target Pair