Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Trace amine-associated receptor 1' and Ligand = 'BDBM96690'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Trace amine-associated receptor 1 (Homo sapiens (Human))	BDBM96690 (4-[[(5-bromanylthiophen-2-yl)sulfonylamino]methyl]...) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)C2CCC(CNS(=O)(=O)c3ccc(Br)s3)CC2)cc1 |(8.62,11.96,;8.62,10.42,;10.16,10.42,;7.08,10.42,;8.62,8.88,;9.95,8.11,;9.95,6.57,;8.62,5.8,;8.62,4.26,;7.29,3.49,;7.29,1.95,;5.95,1.18,;4.62,1.95,;5.95,-.36,;7.29,-1.13,;7.29,-2.67,;5.95,-3.44,;5.95,-4.98,;4.62,-5.75,;4.62,-7.29,;3.08,-7.29,;6.16,-7.29,;4.62,-8.83,;3.37,-9.73,;3.85,-11.2,;5.39,-11.2,;6.3,-12.44,;5.87,-9.73,;4.62,-2.67,;4.62,-1.13,;7.29,6.57,;7.29,8.11,)| Show InChI InChI=1S/C20H26BrN3O5S3/c21-18-9-10-19(30-18)32(28,29)24-13-15-1-5-16(6-2-15)20(25)23-12-11-14-3-7-17(8-4-14)31(22,26)27/h3-4,7-10,15-16,24H,1-2,5-6,11-13H2,(H,23,25)(H2,22,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	1.16E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q280517J
					More data for this Ligand-Target Pair
Trace amine-associated receptor 1 (Homo sapiens (Human))	BDBM96690 (4-[[(5-bromanylthiophen-2-yl)sulfonylamino]methyl]...) Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)C2CCC(CNS(=O)(=O)c3ccc(Br)s3)CC2)cc1 |(8.62,11.96,;8.62,10.42,;10.16,10.42,;7.08,10.42,;8.62,8.88,;9.95,8.11,;9.95,6.57,;8.62,5.8,;8.62,4.26,;7.29,3.49,;7.29,1.95,;5.95,1.18,;4.62,1.95,;5.95,-.36,;7.29,-1.13,;7.29,-2.67,;5.95,-3.44,;5.95,-4.98,;4.62,-5.75,;4.62,-7.29,;3.08,-7.29,;6.16,-7.29,;4.62,-8.83,;3.37,-9.73,;3.85,-11.2,;5.39,-11.2,;6.3,-12.44,;5.87,-9.73,;4.62,-2.67,;4.62,-1.13,;7.29,6.57,;7.29,8.11,)| Show InChI InChI=1S/C20H26BrN3O5S3/c21-18-9-10-19(30-18)32(28,29)24-13-15-1-5-16(6-2-15)20(25)23-12-11-14-3-7-17(8-4-14)31(22,26)27/h3-4,7-10,15-16,24H,1-2,5-6,11-13H2,(H,23,25)(H2,22,26,27)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	>2.99E+4	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2013) BindingDB Entry DOI: 10.7270/Q24748HT
					More data for this Ligand-Target Pair