BDBM85932 4ATMP

SMILES: COC(=O)[C@@H]([C@@H]1CCCCN1)c1ccc(N)cc1

InChI Key: InChIKey=RWBBMMXWHVZGGM-QWHCGFSZSA-N

Data: 2 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 2 hits for monomerid = 85932   

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))	BDBM85932 (4ATMP) Show SMILES COC(=O)[C@@H]([C@@H]1CCCCN1)c1ccc(N)cc1 |r| Show InChI InChI=1S/C14H20N2O2/c1-18-14(17)13(12-4-2-3-9-16-12)10-5-7-11(15)8-6-10/h5-8,12-13,16H,2-4,9,15H2,1H3/t12-,13+/m0/s1	Reactome pathway KEGG GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	34.5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Mercer University Curated by PDSP Ki Database									J Pharmacol Exp Ther 301: 527-35 (2002) Article DOI: 10.1124/jpet.301.2.527 BindingDB Entry DOI: 10.7270/Q2C53JFB
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Rattus norvegicus (rat))	BDBM85932 (4ATMP) Show SMILES COC(=O)[C@@H]([C@@H]1CCCCN1)c1ccc(N)cc1 |r| Show InChI InChI=1S/C14H20N2O2/c1-18-14(17)13(12-4-2-3-9-16-12)10-5-7-11(15)8-6-10/h5-8,12-13,16H,2-4,9,15H2,1H3/t12-,13+/m0/s1	PDB KEGG GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Mercer University Curated by PDSP Ki Database									J Pharmacol Exp Ther 301: 527-35 (2002) Article DOI: 10.1124/jpet.301.2.527 BindingDB Entry DOI: 10.7270/Q2C53JFB
					More data for this Ligand-Target Pair