Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Trace amine-associated receptor 1' and Ligand = 'BDBM96868'   

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))	BDBM96868 ((2S)-N-[2-(2-chlorophenyl)ethyl]-1-[(2S)-2-(cyclop...) Show SMILES Clc1ccccc1CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cccnc1)NC(=O)C1CCCC1 Show InChI InChI=1S/C27H33ClN4O3/c28-22-11-4-3-8-20(22)13-15-30-26(34)24-12-6-16-32(24)27(35)23(17-19-7-5-14-29-18-19)31-25(33)21-9-1-2-10-21/h3-5,7-8,11,14,18,21,23-24H,1-2,6,9-10,12-13,15-17H2,(H,30,34)(H,31,33)/t23-,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.72E+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))	BDBM96868 ((2S)-N-[2-(2-chlorophenyl)ethyl]-1-[(2S)-2-(cyclop...) Show SMILES Clc1ccccc1CCNC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cccnc1)NC(=O)C1CCCC1 Show InChI InChI=1S/C27H33ClN4O3/c28-22-11-4-3-8-20(22)13-15-30-26(34)24-12-6-16-32(24)27(35)23(17-19-7-5-14-29-18-19)31-25(33)21-9-1-2-10-21/h3-5,7-8,11,14,18,21,23-24H,1-2,6,9-10,12-13,15-17H2,(H,30,34)(H,31,33)/t23-,24-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	n/a	n/a	2.91E+3	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