Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Kappa-type opioid receptor' and Ligand = 'BDBM235807'   

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
Kappa-type opioid receptor (Homo sapiens (Human))	BDBM235807 (US9359399, 21) Show SMILES CCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CNC(N)=N)C(=O)N1CCCNCC1 |r| Show InChI InChI=1S/C33H49N9O4/c1-2-3-15-26(30(44)41-28(22-38-33(35)36)32(46)42-18-10-16-37-17-19-42)39-31(45)27(21-24-13-8-5-9-14-24)40-29(43)25(34)20-23-11-6-4-7-12-23/h4-9,11-14,25-28,37H,2-3,10,15-22,34H2,1H3,(H,39,45)(H,40,43)(H,41,44)(H4,35,36,38)/t25-,26-,27-,28-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	1.06	n/a	n/a	n/a	25
Cara Therapeutics, Inc. US Patent					Assay Description Mouse R1.G1 cells (ATCC, Manassas, Va.) were grown in suspension in high glucose-DMEM (Dulbecco's Modified Eagle's Medium, Cellgro, Herndon, Va.) con...				US Patent US9359399 (2016) BindingDB Entry DOI: 10.7270/Q23B5Z2C
					More data for this Ligand-Target Pair
Kappa-type opioid receptor (Mus musculus (Mouse))	BDBM235807 (US9359399, 21) Show SMILES CCCC[C@@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)[C@H](N)Cc1ccccc1)C(=O)N[C@H](CNC(N)=N)C(=O)N1CCCNCC1 |r| Show InChI InChI=1S/C33H49N9O4/c1-2-3-15-26(30(44)41-28(22-38-33(35)36)32(46)42-18-10-16-37-17-19-42)39-31(45)27(21-24-13-8-5-9-14-24)40-29(43)25(34)20-23-11-6-4-7-12-23/h4-9,11-14,25-28,37H,2-3,10,15-22,34H2,1H3,(H,39,45)(H,40,43)(H,41,44)(H4,35,36,38)/t25-,26-,27-,28-/m1/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.732	n/a	n/a	n/a	25
Cara Therapeutics, Inc. US Patent					Assay Description Mouse R1.G1 cells (ATCC, Manassas, Va.) were grown in suspension in high glucose-DMEM (Dulbecco's Modified Eagle's Medium, Cellgro, Herndon, Va.) con...				US Patent US9359399 (2016) BindingDB Entry DOI: 10.7270/Q23B5Z2C
					More data for this Ligand-Target Pair