BDBM50069444 (1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl)-propan-1-ol; hydrochloride::CHEMBL539054

SMILES: Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1

InChI Key: InChIKey=UMGBWEFVYXSKML-FUHWJXTLSA-N

Data: 3 KI  3 Kd

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 6 hits for monomerid = 50069444   

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 (Rattus norvegicus (rat))	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	643	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of [3H]5-HT reuptake into rat frontal cortex synaptosomes				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Rattus norvegicus (rat))	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.31E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of [3H]- DA reuptake into rat striatal synaptosomes				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair
Norepinephrine Monoamine transporters (Rattus norvegicus)	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	Reactome pathway KEGG UniProtKB/TrEMBL GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	8.60E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Inhibition of [3H]- NE reuptake into rat hippocampal synaptosomes				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair
Sodium-dependent dopamine transporter (Homo sapiens (Human))	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Equilibrium dissociation constant (KD) for Competitive binding between [3H]WIN-35428 and the compound at human transporter-hDAT				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair
Sodium-dependent noradrenaline transporter (Homo sapiens (Human))	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	2.25E+4	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Equilibrium dissociation constant (KD) for Competitive binding between [3H]- nisoxatine and the compound at human Norepinephrine transporter				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair
Sodium-dependent serotonin transporter (Homo sapiens (Human))	BDBM50069444 ((1R,2R)-3-Amino-2-phenyl-1-(2,4,6-trimethyl-phenyl...) Show SMILES Cc1cc(C)c([C@H](O)[C@@H](CN)c2ccccc2)c(C)c1 Show InChI InChI=1S/C18H23NO/c1-12-9-13(2)17(14(3)10-12)18(20)16(11-19)15-7-5-4-6-8-15/h4-10,16,18,20H,11,19H2,1-3H3/t16-,18+/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	n/a	118	n/a	n/a	n/a	n/a	n/a
Hong Kong University of Science and Technology Curated by ChEMBL					Assay Description Equilibrium dissociation constant (KD) for Competitive binding between [3H]- imipramine and the compound at human transporter-hSERT				Bioorg Med Chem Lett 8: 487-92 (1999) BindingDB Entry DOI: 10.7270/Q2F76D26
					More data for this Ligand-Target Pair