Found 4 hits Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM360103' 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)) | BDBM360103
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3-p...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,21.23,(-9.31,-4.34,;-10.64,-5.11,;-11.98,-4.34,;-12.02,-2.77,;-13.36,-2,;-14.69,-2.77,;-14.69,-4.31,;-16.02,-5.08,;-17.2,-4.09,;-13.36,-5.08,;-13.36,-6.62,;-12.11,-7.52,;-10.65,-7.05,;-9.31,-7.82,;-10.08,-9.15,;-8.54,-9.15,;-7.98,-7.05,;-7.98,-5.51,;-6.65,-7.82,;-6.65,-9.36,;-5.31,-10.13,;-5.31,-11.67,;-3.98,-12.44,;-6.65,-12.44,;-5.31,-7.05,;-3.98,-7.82,;-2.64,-7.05,;-2.64,-5.51,;-1.31,-4.74,;-3.98,-4.74,;-5.31,-5.51,;-12.59,-8.99,;-14.13,-8.99,;-14.6,-7.52,;-16.07,-7.05,;-16.84,-8.38,;-18.38,-8.38,;-19.15,-7.05,;-18.38,-5.71,;-19.15,-4.38,;-16.84,-5.71,)| Show InChI InChI=1S/C27H33N7O6S/c1-16-10-20(14-28-11-16)26-31-32-27(34(26)23-21(38-5)8-7-9-22(23)39-6)33-41(36,37)19(4)24(40-15-18(3)35)25-29-12-17(2)13-30-25/h7-14,18-19,24,35H,15H2,1-6H3,(H,32,33)/t18-,19+,24+/m1/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 | 17 | 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 US10221162 (2019)
BindingDB Entry DOI: 10.7270/Q2ZK5JXS |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM360103
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3-p...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,21.23,(-9.31,-4.34,;-10.64,-5.11,;-11.98,-4.34,;-12.02,-2.77,;-13.36,-2,;-14.69,-2.77,;-14.69,-4.31,;-16.02,-5.08,;-17.2,-4.09,;-13.36,-5.08,;-13.36,-6.62,;-12.11,-7.52,;-10.65,-7.05,;-9.31,-7.82,;-10.08,-9.15,;-8.54,-9.15,;-7.98,-7.05,;-7.98,-5.51,;-6.65,-7.82,;-6.65,-9.36,;-5.31,-10.13,;-5.31,-11.67,;-3.98,-12.44,;-6.65,-12.44,;-5.31,-7.05,;-3.98,-7.82,;-2.64,-7.05,;-2.64,-5.51,;-1.31,-4.74,;-3.98,-4.74,;-5.31,-5.51,;-12.59,-8.99,;-14.13,-8.99,;-14.6,-7.52,;-16.07,-7.05,;-16.84,-8.38,;-18.38,-8.38,;-19.15,-7.05,;-18.38,-5.71,;-19.15,-4.38,;-16.84,-5.71,)| Show InChI InChI=1S/C27H33N7O6S/c1-16-10-20(14-28-11-16)26-31-32-27(34(26)23-21(38-5)8-7-9-22(23)39-6)33-41(36,37)19(4)24(40-15-18(3)35)25-29-12-17(2)13-30-25/h7-14,18-19,24,35H,15H2,1-6H3,(H,32,33)/t18-,19+,24+/m1/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 | 0.210 | 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 US10221162 (2019)
BindingDB Entry DOI: 10.7270/Q2ZK5JXS |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM360103
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3-p...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,21.23,(-9.31,-4.34,;-10.64,-5.11,;-11.98,-4.34,;-12.02,-2.77,;-13.36,-2,;-14.69,-2.77,;-14.69,-4.31,;-16.02,-5.08,;-17.2,-4.09,;-13.36,-5.08,;-13.36,-6.62,;-12.11,-7.52,;-10.65,-7.05,;-9.31,-7.82,;-10.08,-9.15,;-8.54,-9.15,;-7.98,-7.05,;-7.98,-5.51,;-6.65,-7.82,;-6.65,-9.36,;-5.31,-10.13,;-5.31,-11.67,;-3.98,-12.44,;-6.65,-12.44,;-5.31,-7.05,;-3.98,-7.82,;-2.64,-7.05,;-2.64,-5.51,;-1.31,-4.74,;-3.98,-4.74,;-5.31,-5.51,;-12.59,-8.99,;-14.13,-8.99,;-14.6,-7.52,;-16.07,-7.05,;-16.84,-8.38,;-18.38,-8.38,;-19.15,-7.05,;-18.38,-5.71,;-19.15,-4.38,;-16.84,-5.71,)| Show InChI InChI=1S/C27H33N7O6S/c1-16-10-20(14-28-11-16)26-31-32-27(34(26)23-21(38-5)8-7-9-22(23)39-6)33-41(36,37)19(4)24(40-15-18(3)35)25-29-12-17(2)13-30-25/h7-14,18-19,24,35H,15H2,1-6H3,(H,32,33)/t18-,19+,24+/m1/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 | 0.860 | 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 US10221162 (2019)
BindingDB Entry DOI: 10.7270/Q2ZK5JXS |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM360103
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3-p...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OC[C@@H](C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,21.23,(-9.31,-4.34,;-10.64,-5.11,;-11.98,-4.34,;-12.02,-2.77,;-13.36,-2,;-14.69,-2.77,;-14.69,-4.31,;-16.02,-5.08,;-17.2,-4.09,;-13.36,-5.08,;-13.36,-6.62,;-12.11,-7.52,;-10.65,-7.05,;-9.31,-7.82,;-10.08,-9.15,;-8.54,-9.15,;-7.98,-7.05,;-7.98,-5.51,;-6.65,-7.82,;-6.65,-9.36,;-5.31,-10.13,;-5.31,-11.67,;-3.98,-12.44,;-6.65,-12.44,;-5.31,-7.05,;-3.98,-7.82,;-2.64,-7.05,;-2.64,-5.51,;-1.31,-4.74,;-3.98,-4.74,;-5.31,-5.51,;-12.59,-8.99,;-14.13,-8.99,;-14.6,-7.52,;-16.07,-7.05,;-16.84,-8.38,;-18.38,-8.38,;-19.15,-7.05,;-18.38,-5.71,;-19.15,-4.38,;-16.84,-5.71,)| Show InChI InChI=1S/C27H33N7O6S/c1-16-10-20(14-28-11-16)26-31-32-27(34(26)23-21(38-5)8-7-9-22(23)39-6)33-41(36,37)19(4)24(40-15-18(3)35)25-29-12-17(2)13-30-25/h7-14,18-19,24,35H,15H2,1-6H3,(H,32,33)/t18-,19+,24+/m1/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 | 21 | 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 US10221162 (2019)
BindingDB Entry DOI: 10.7270/Q2ZK5JXS |
More data for this
Ligand-Target Pair | |
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