BDBM50203932 (S)-N-(2,3-dimethylbenzyl)-N-(pyridin-2-ylmethyl)pyrrolidin-3-amine::CHEMBL245482

SMILES: Cc1cccc(CN(Cc2ccccn2)[C@H]2CCNC2)c1C

InChI Key: InChIKey=CHDGVSNCSOCUHK-IBGZPJMESA-N

Data: 3 IC50

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 = 50203932   

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 serotonin transporter (Homo sapiens (Human))	BDBM50203932 ((S)-N-(2,3-dimethylbenzyl)-N-(pyridin-2-ylmethyl)p...) Show SMILES Cc1cccc(CN(Cc2ccccn2)[C@H]2CCNC2)c1C Show InChI InChI=1S/C19H25N3/c1-15-6-5-7-17(16(15)2)13-22(19-9-11-20-12-19)14-18-8-3-4-10-21-18/h3-8,10,19-20H,9,11-14H2,1-2H3/t19-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]5HT from human SERT expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2022-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.020 BindingDB Entry DOI: 10.7270/Q20R9P2S
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50203932 ((S)-N-(2,3-dimethylbenzyl)-N-(pyridin-2-ylmethyl)p...) Show SMILES Cc1cccc(CN(Cc2ccccn2)[C@H]2CCNC2)c1C Show InChI InChI=1S/C19H25N3/c1-15-6-5-7-17(16(15)2)13-22(19-9-11-20-12-19)14-18-8-3-4-10-21-18/h3-8,10,19-20H,9,11-14H2,1-2H3/t19-/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]DA from human DAT expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2022-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.020 BindingDB Entry DOI: 10.7270/Q20R9P2S
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50203932 ((S)-N-(2,3-dimethylbenzyl)-N-(pyridin-2-ylmethyl)p...) Show SMILES Cc1cccc(CN(Cc2ccccn2)[C@H]2CCNC2)c1C Show InChI InChI=1S/C19H25N3/c1-15-6-5-7-17(16(15)2)13-22(19-9-11-20-12-19)14-18-8-3-4-10-21-18/h3-8,10,19-20H,9,11-14H2,1-2H3/t19-/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	12	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Global Research and Development Curated by ChEMBL					Assay Description Inhibition of [3H]NA from human NET expressed in HEK293 cells				Bioorg Med Chem Lett 17: 2022-5 (2007) Article DOI: 10.1016/j.bmcl.2007.01.020 BindingDB Entry DOI: 10.7270/Q20R9P2S
					More data for this Ligand-Target Pair