Compile Data Set for Download or QSAR

Found 9 hits Enz. Inhib. hit(s) with Target = 'Prokineticin Receptor 2 (PKR2)'   

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
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM26335 (3-[2-({5-[(4-ethylphenyl)methyl]-1-[(4-methoxyphen...) Show SMILES [#6]-[#6]-c1ccc(-[#6]-n2c(=O)nc(-[#7]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])n(-[#6]-c3ccc(-[#8]-[#6])cc3)c2=O)cc1 Show InChI InChI=1S/C23H29N7O3/c1-3-16-4-6-17(7-5-16)15-30-22(31)28-21(27-13-12-26-20(24)25)29(23(30)32)14-18-8-10-19(33-2)11-9-18/h4-11H,3,12-15H2,1-2H3,(H4,24,25,26)(H,27,28,31)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	1.61E+3	-34.4	n/a	n/a	n/a	n/a	n/a	7.4	37
University of Ferrara					Assay Description Nonspecific binding was determined in the presence of 1 uM Bv8. Displacement curves were determined in triplicate. The inhibition constant (Ki) of th...				J Med Chem 51: 7635-9 (2008) Article DOI: 10.1021/jm800854e BindingDB Entry DOI: 10.7270/Q23J3B9C
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM26336 (6-[(2-aminoethyl)amino]-3-[(4-ethylphenyl)methyl]-...) Show SMILES CCc1ccc(Cn2c(=O)nc(NCCN)n(Cc3ccc(OC)cc3)c2=O)cc1 Show InChI InChI=1S/C22H27N5O3/c1-3-16-4-6-17(7-5-16)15-27-21(28)25-20(24-13-12-23)26(22(27)29)14-18-8-10-19(30-2)11-9-18/h4-11H,3,12-15,23H2,1-2H3,(H,24,25,28)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	2.34E+4	-27.5	n/a	n/a	n/a	n/a	n/a	7.4	37
University of Ferrara					Assay Description Nonspecific binding was determined in the presence of 1 uM Bv8. Displacement curves were determined in triplicate. The inhibition constant (Ki) of th...				J Med Chem 51: 7635-9 (2008) Article DOI: 10.1021/jm800854e BindingDB Entry DOI: 10.7270/Q23J3B9C
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM26337 (6-{[2-(4,5-dihydro-1H-imidazol-2-ylamino)ethyl]ami...) Show SMILES [#6]-[#6]-c1ccc(-[#6]-n2c(=O)nc(-[#7]-[#6]-[#6]\[#7]=[#6]-3/[#7]-[#6]-[#6]-[#7]-3)n(-[#6]-c3ccc(-[#8]-[#6])cc3)c2=O)cc1 Show InChI InChI=1S/C25H31N7O3/c1-3-18-4-6-19(7-5-18)17-32-24(33)30-23(29-15-14-28-22-26-12-13-27-22)31(25(32)34)16-20-8-10-21(35-2)11-9-20/h4-11H,3,12-17H2,1-2H3,(H2,26,27,28)(H,29,30,33)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	7.12E+4	-24.6	n/a	n/a	n/a	n/a	n/a	7.4	37
University of Ferrara					Assay Description Nonspecific binding was determined in the presence of 1 uM Bv8. Displacement curves were determined in triplicate. The inhibition constant (Ki) of th...				J Med Chem 51: 7635-9 (2008) Article DOI: 10.1021/jm800854e BindingDB Entry DOI: 10.7270/Q23J3B9C
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM121129 (A457 | US8722896, (+/-)-1-Benzyl-N-(9-chloro-3,4- ...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CCN(Cc2ccccc2)C1 Show InChI InChI=1S/C26H33ClN2O3/c1-19(2)15-29(17-21-13-23(27)25-24(14-21)31-11-6-12-32-25)26(30)22-9-10-28(18-22)16-20-7-4-3-5-8-20/h3-5,7-8,13-14,19,22H,6,9-12,15-18H2,1-2H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	7.5	37
Central South University; Changsha Medical University					Assay Description Briefly, Chinese hamster ovary cells stably expressing the photoprotein aequorin were transiently transfected with WT or respective mutant PKR2-expre...				J Biol Chem 289: 15518-26 (2014) Article DOI: 10.1074/jbc.M114.556381 BindingDB Entry DOI: 10.7270/Q2H9943S
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM463312 ((-)-(2R)-1-(benzimidazol-4- ylmethyl)-N-(9-chloro-...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CN(Cc2cccc3nc[nH]c23)CCO1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.30	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US10780095 (2020) BindingDB Entry DOI: 10.7270/Q22F7RH6
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM463307 ((-)-(3R)-1-(benzimidazol-4- ylmethyl)-N-(9-chloro-...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CCN(Cc2cccc3nc[nH]c23)C1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.70	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US10780095 (2020) BindingDB Entry DOI: 10.7270/Q22F7RH6
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM463306 ((-)-(2R)-1-(4-Fluoro-3- methoxybenzyl)-N-(9-chloro...) Show SMILES COc1cc(CN2CCOC(C2)C(=O)N(CC(C)C)Cc2cc(Cl)c3OCCCOc3c2)ccc1F Show InChI InChI=1S/C27H34ClFN2O5/c1-18(2)14-31(16-20-11-21(28)26-24(13-20)34-8-4-9-36-26)27(32)25-17-30(7-10-35-25)15-19-5-6-22(29)23(12-19)33-3/h5-6,11-13,18,25H,4,7-10,14-17H2,1-3H3	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	1.90	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US10780095 (2020) BindingDB Entry DOI: 10.7270/Q22F7RH6
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM463309 ((+-)-2-Methyl-3-(benzimidazol- 4-ylmethylamino)-N-...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C(C)CNCc1cccc2nc[nH]c12 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	2.10	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US10780095 (2020) BindingDB Entry DOI: 10.7270/Q22F7RH6
					More data for this Ligand-Target Pair
Prokineticin receptor 2 (Homo sapiens (Human))	BDBM463311 ((-)-(3R)-1-(benzimidazol-4- ylmethyl)-N-(9-chloro-...) Show SMILES CC(C)CN(Cc1cc(Cl)c2OCCCOc2c1)C(=O)C1CCCN(Cc2cccc3nc[nH]c23)C1 Show InChI	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
THE REGENTS OF THE UNIVERSITY OF CALIFORNIA US Patent					Assay Description An aequorin-based luminescent assay for calcium mobilization was used to measure mobilization of intracellular Ca2+ (Bullock et al., Mol Pharmacol 65...				US Patent US10780095 (2020) BindingDB Entry DOI: 10.7270/Q22F7RH6
					More data for this Ligand-Target Pair