Found 9 hits Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM269651' 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)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 2.5 | n/a | n/a | 7.5 | 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 US10058550 (2018)
BindingDB Entry DOI: 10.7270/Q26T0PP0 |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 6.80 | n/a | n/a | 7.5 | 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 US10058550 (2018)
BindingDB Entry DOI: 10.7270/Q26T0PP0 |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 1.10 | n/a | n/a | 7.5 | 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 US10058550 (2018)
BindingDB Entry DOI: 10.7270/Q26T0PP0 |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 2.5 | 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)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 1.10 | 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 (Sig... |
US Patent US9845310 (2017)
BindingDB Entry DOI: 10.7270/Q28P62TV |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 1.10 | 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)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 2.5 | 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 (Sig... |
US Patent US9845310 (2017)
BindingDB Entry DOI: 10.7270/Q28P62TV |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 6.80 | 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 (Sig... |
US Patent US9845310 (2017)
BindingDB Entry DOI: 10.7270/Q28P62TV |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM269651
(6-(4-(2,6-dimethoxyphenyl)-5-((((1R,2S)-2-(5-fluor...)Show SMILES CNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:18.19,20.21,(-8.12,-5.43,;-7.35,-4.1,;-8.12,-2.76,;-9.66,-2.76,;-7.35,-1.43,;-8.12,-.1,;-7.35,1.24,;-5.81,1.24,;-5.04,-.1,;-5.81,-1.43,;-3.5,-.1,;-3.02,-1.56,;-1.48,-1.56,;-1.01,-.1,;.32,.67,;1.66,-.1,;.89,-1.43,;2.43,-1.43,;2.99,.67,;2.99,2.21,;4.33,-.1,;4.33,-1.64,;5.66,.67,;6.99,-.1,;8.33,.67,;8.33,2.21,;9.66,2.98,;6.99,2.98,;5.66,2.21,;-2.25,.81,;-2.25,2.35,;-.92,3.12,;.41,2.35,;1.75,3.12,;-.92,4.66,;-2.25,5.43,;-3.59,4.66,;-3.59,3.12,;-4.92,2.35,;-6.26,3.12,)| Show InChI InChI=1S/C25H27FN8O5S/c1-14(22-28-12-16(26)13-29-22)15(2)40(36,37)33-25-32-31-23(17-8-6-9-18(30-17)24(35)27-3)34(25)21-19(38-4)10-7-11-20(21)39-5/h6-15H,1-5H3,(H,27,35)(H,32,33)/t14-,15-/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 | 6.80 | 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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