Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM447997'   

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
Apelin receptor (Homo sapiens (Human))	BDBM447997 (US10689367, Example 325.0 | US10689367, Example 32...) Show SMILES CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r| Show InChI InChI=1S/C24H32ClN7O5S/c1-5-18(19-10-6-7-12-37-19)32-23(17-9-8-11-20(28-17)35-3)29-30-24(32)31-38(33,34)15(2)21(36-4)22-26-13-16(25)14-27-22/h8-9,11,13-15,18-19,21H,5-7,10,12H2,1-4H3,(H,30,31)/t15-,18+,19-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.330	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10689367 (2020) BindingDB Entry DOI: 10.7270/Q2P84FXK
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM447997 (US10689367, Example 325.0 | US10689367, Example 32...) Show SMILES CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r| Show InChI InChI=1S/C24H32ClN7O5S/c1-5-18(19-10-6-7-12-37-19)32-23(17-9-8-11-20(28-17)35-3)29-30-24(32)31-38(33,34)15(2)21(36-4)22-26-13-16(25)14-27-22/h8-9,11,13-15,18-19,21H,5-7,10,12H2,1-4H3,(H,30,31)/t15-,18+,19-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.0640	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10689367 (2020) BindingDB Entry DOI: 10.7270/Q2P84FXK
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM447997 (US10689367, Example 325.0 | US10689367, Example 32...) Show SMILES CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r| Show InChI InChI=1S/C24H32ClN7O5S/c1-5-18(19-10-6-7-12-37-19)32-23(17-9-8-11-20(28-17)35-3)29-30-24(32)31-38(33,34)15(2)21(36-4)22-26-13-16(25)14-27-22/h8-9,11,13-15,18-19,21H,5-7,10,12H2,1-4H3,(H,30,31)/t15-,18+,19-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.110	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10689367 (2020) BindingDB Entry DOI: 10.7270/Q2P84FXK
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM447997 (US10689367, Example 325.0 | US10689367, Example 32...) Show SMILES CC[C@H]([C@@H]1CCCCO1)n1c(NS(=O)(=O)[C@@H](C)[C@H](OC)c2ncc(Cl)cn2)nnc1-c1cccc(OC)n1 |r| Show InChI InChI=1S/C24H32ClN7O5S/c1-5-18(19-10-6-7-12-37-19)32-23(17-9-8-11-20(28-17)35-3)29-30-24(32)31-38(33,34)15(2)21(36-4)22-26-13-16(25)14-27-22/h8-9,11,13-15,18-19,21H,5-7,10,12H2,1-4H3,(H,30,31)/t15-,18+,19-,21-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	0.140	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10689367 (2020) BindingDB Entry DOI: 10.7270/Q2P84FXK
					More data for this Ligand-Target Pair