Found 788 hits of Enzyme Inhibition Constant Data 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)) | BDBM269511
(US10058550, Example 543.0 | yl)-1-methoxy-1-(5-met...)Show SMILES CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:3.3,2.1,(1.74,-4.79,;3.08,-4.02,;3.08,-2.48,;1.99,-1.39,;2.39,.1,;.5,-1.79,;-.59,-2.88,;.9,-3.28,;-.59,-.7,;-2.07,-1.1,;-2.55,-2.56,;-4.09,-2.56,;-4.57,-1.1,;-6.05,-.7,;-7.14,-1.79,;-8.63,-1.39,;-9.03,.1,;-7.94,1.19,;-8.34,2.67,;-6.45,.79,;-3.32,-.19,;-3.32,1.71,;-4.65,2.48,;-5.99,1.71,;-7.32,2.48,;-4.65,4.02,;-3.32,4.79,;-1.99,4.02,;-1.99,2.48,;-.65,1.71,;.68,2.48,;4.57,-2.08,;5.66,-3.17,;7.14,-2.77,;7.54,-1.28,;9.03,-.88,;6.45,-.19,;4.96,-.59,)| Show InChI InChI=1S/C25H29N7O5S/c1-15-10-18(14-26-11-15)24-29-30-25(32(24)21-19(35-4)8-7-9-20(21)36-5)31-38(33,34)17(3)22(37-6)23-27-12-16(2)13-28-23/h7-14,17,22H,1-6H3,(H,30,31)/t17-,22-/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 | 62 | 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)) | BDBM269538
(US10058550, Example 54.0 | US10221162, Example 54....)Show SMILES CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C(=O)OC)c1ncc(C)cn1 |r| Show InChI InChI=1S/C25H27N7O6S/c1-15-13-26-22(27-14-15)21(37-4)16(2)39(34,35)31-25-30-29-23(19-10-7-11-20(28-19)36-3)32(25)18-9-6-8-17(12-18)24(33)38-5/h6-14,16,21H,1-5H3,(H,30,31)/t16-,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 | 12 | 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)) | BDBM269549
((1R,2S)-N-(4-(4-fluorophenyl)-5-(6-methoxy-2-pyrid...)Show SMILES CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1ccc(F)cc1)c1ncc(C)cn1 |r| Show InChI InChI=1S/C23H24FN7O4S/c1-14-12-25-21(26-13-14)20(35-4)15(2)36(32,33)30-23-29-28-22(18-6-5-7-19(27-18)34-3)31(23)17-10-8-16(24)9-11-17/h5-13,15,20H,1-4H3,(H,29,30)/t15-,20-/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 | 180 | 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)) | BDBM269556
((1R,2S)-N-(4-(3-acetylphenyl)-5-(6-methoxy-2-pyrid...)Show SMILES CO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1cccc(c1)C(C)=O)c1ncc(C)cn1 |r| Show InChI InChI=1S/C25H27N7O5S/c1-15-13-26-23(27-14-15)22(37-5)17(3)38(34,35)31-25-30-29-24(20-10-7-11-21(28-20)36-4)32(25)19-9-6-8-18(12-19)16(2)33/h6-14,17,22H,1-5H3,(H,30,31)/t17-,22-/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 | 9.10 | 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)) | BDBM269570
((2S,3R)-N-(4-(2,6-dimethoxyphenyl)-5-(2-methoxy-4-...)Show SMILES COc1cc(ccn1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-9.9,-2.97,;-8.41,-3.37,;-7.32,-2.28,;-5.84,-2.68,;-4.75,-1.59,;-5.15,-.11,;-6.63,.29,;-7.72,-.8,;-3.26,-1.99,;-2.78,-3.46,;-1.24,-3.46,;-.77,-1.99,;.57,-1.22,;1.9,-1.99,;1.13,-3.33,;2.67,-3.33,;3.23,-1.22,;3.23,.32,;4.57,-1.99,;4.57,-3.53,;5.9,-1.22,;7.23,-1.99,;8.57,-1.22,;8.57,.32,;9.9,1.09,;7.23,1.09,;5.9,.32,;-2.01,-1.09,;-2.01,.45,;-3.35,1.22,;-4.68,.45,;-6.02,1.22,;-3.35,2.76,;-2.01,3.53,;-.68,2.76,;-.68,1.22,;.65,.45,;1.99,1.22,)| Show InChI InChI=1S/C25H29N7O5S/c1-15-13-27-23(28-14-15)16(2)17(3)38(33,34)31-25-30-29-24(18-10-11-26-21(12-18)37-6)32(25)22-19(35-4)8-7-9-20(22)36-5/h7-14,16-17H,1-6H3,(H,30,31)/t16-,17-/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 | 5.20 | 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)) | BDBM269579
((1R,2S)-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)C)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-6.76,2.38,;-5.43,1.61,;-4.09,2.38,;-4.09,3.92,;-2.76,4.69,;-1.42,3.92,;-1.42,2.38,;-.09,1.61,;1.24,2.38,;-2.76,1.61,;-2.76,.07,;-1.51,-.84,;-.18,-.07,;1.15,-.84,;.38,-2.17,;1.92,-2.17,;2.49,-.07,;2.49,1.47,;3.82,-.84,;3.82,-2.38,;5.16,-3.15,;6.49,-2.38,;5.16,-4.69,;5.16,-.07,;6.49,-.84,;7.82,-.07,;7.82,1.47,;9.16,2.24,;6.49,2.24,;5.16,1.47,;-1.99,-2.3,;-3.53,-2.3,;-4,-.84,;-5.49,-.44,;-5.89,1.05,;-7.38,1.45,;-8.47,.36,;-8.07,-1.13,;-9.16,-2.22,;-6.58,-1.53,)| Show InChI InChI=1S/C27H33N7O5S/c1-16(2)39-24(25-29-13-18(4)14-30-25)19(5)40(35,36)33-27-32-31-26(20-11-17(3)12-28-15-20)34(27)23-21(37-6)9-8-10-22(23)38-7/h8-16,19,24H,1-7H3,(H,32,33)/t19-,24-/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 | 0.570 | 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)) | BDBM269594
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(3-pyridinyl)...)Show SMILES CCO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccnc2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wD:4.4,3.2,(4.86,-4.69,;4.86,-3.15,;3.53,-2.38,;3.53,-.84,;2.2,-.07,;2.2,1.47,;.86,-.84,;.09,-2.17,;1.63,-2.17,;-.47,-.07,;-1.81,-.84,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-3.05,.07,;-3.05,1.61,;-1.59,2.32,;-.25,1.55,;1.08,2.33,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,)| Show InChI InChI=1S/C25H29N7O5S/c1-6-37-22(23-27-13-16(2)14-28-23)17(3)38(33,34)31-25-30-29-24(18-9-8-12-26-15-18)32(25)21-19(35-4)10-7-11-20(21)36-5/h7-15,17,22H,6H2,1-5H3,(H,30,31)/t17-,22-/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 | 150 | 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)) | BDBM269599
((2S)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methoxy-3-pyr...)Show SMILES COc1cncc(c1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,1.97,;-8.89,.64,;-8.12,-.7,;-8.89,-2.03,;-8.12,-3.36,;-6.58,-3.36,;-5.81,-2.03,;-6.58,-.7,;-4.27,-2.03,;-3.79,-3.49,;-2.25,-3.49,;-1.78,-2.03,;-.45,-1.26,;.89,-2.03,;.12,-3.36,;1.66,-3.36,;2.22,-1.26,;2.22,.28,;3.56,-2.03,;4.89,-1.26,;6.22,-2.03,;7.56,-1.26,;7.56,.28,;8.89,1.05,;6.22,1.05,;4.89,.28,;-3.02,-1.13,;-3.02,.41,;-4.36,1.18,;-5.69,.41,;-7.03,1.18,;-4.36,2.72,;-3.02,3.49,;-1.69,2.72,;-1.69,1.18,;-.36,.41,;.98,1.18,)| Show InChI InChI=1S/C23H24FN7O5S/c1-14(8-20-26-11-16(24)12-27-20)37(32,33)30-23-29-28-22(15-9-17(34-2)13-25-10-15)31(23)21-18(35-3)6-5-7-19(21)36-4/h5-7,9-14H,8H2,1-4H3,(H,29,30)/t14-/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 | 4.70 | 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)) | BDBM269601
((2R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyr...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-8.12,-4.76,;-8.89,-3.43,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-6.58,-2.1,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,;-4.36,3.99,;-3.02,4.76,;-1.69,3.99,;-1.69,2.45,;-.36,1.68,;.98,2.45,)| Show InChI InChI=1S/C23H24FN7O5S/c1-14(11-19-25-12-15(24)13-26-19)37(32,33)30-23-29-28-22(16-7-5-10-20(27-16)36-4)31(23)21-17(34-2)8-6-9-18(21)35-3/h5-10,12-14H,11H2,1-4H3,(H,29,30)/t14-/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 | 0.180 | 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)) | BDBM269610
((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](O)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.08,2.33,;-.25,1.55,;-1.59,2.32,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;-3.05,1.61,;-3.05,.07,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;3.53,-2.38,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-8.86,-3.11,;-6.55,-1.77,)| Show InChI InChI=1S/C23H24FN7O5S/c1-13-8-15(10-25-9-13)22-28-29-23(31(22)19-17(35-3)6-5-7-18(19)36-4)30-37(33,34)14(2)20(32)21-26-11-16(24)12-27-21/h5-12,14,20,32H,1-4H3,(H,29,30)/t14-,20-/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)) | BDBM269613
((2R,3S)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.38,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.38,;2.13,1.72,;4.44,.38,;5.21,-.95,;5.21,1.72,;6.75,1.72,;7.52,3.05,;6.75,4.39,;7.52,5.72,;5.21,4.39,;4.44,3.05,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)| Show InChI InChI=1S/C24H26FN7O5S/c1-14(22-26-12-16(25)13-27-22)15(2)38(33,34)31-24-30-29-23(17-8-6-11-20(28-17)37-5)32(24)21-18(35-3)9-7-10-19(21)36-4/h6-15H,1-5H3,(H,30,31)/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 | 0.110 | 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)) | BDBM269616
((1S,2R)-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@H](O)c2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,18.19,(-6.75,-5.72,;-7.52,-4.39,;-6.75,-3.05,;-7.52,-1.72,;-6.75,-.38,;-5.21,-.38,;-4.44,-1.72,;-5.21,-3.05,;-2.9,-1.72,;-2,-2.96,;-.53,-2.49,;-.53,-.95,;.8,-.18,;2.13,-.95,;1.36,-2.28,;3.47,-1.72,;2.9,.38,;2.13,1.72,;4.44,.38,;5.21,-.95,;5.21,1.72,;6.75,1.72,;7.52,3.05,;6.75,4.39,;7.52,5.72,;5.21,4.39,;4.44,3.05,;-2,-.47,;-2.4,1.01,;-1.31,2.1,;.18,1.71,;1.27,2.79,;-1.71,3.59,;-3.19,3.99,;-4.28,2.9,;-3.88,1.41,;-4.97,.32,;-6.46,.72,)| Show InChI InChI=1S/C23H24FN7O6S/c1-13(20(32)21-25-11-14(24)12-26-21)38(33,34)30-23-29-28-22(15-7-5-10-18(27-15)37-4)31(23)19-16(35-2)8-6-9-17(19)36-3/h5-13,20,32H,1-4H3,(H,29,30)/t13-,20-/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 | 0.460 | 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)) | BDBM269623
((2S)-N-(4-(2,6-dimethoxyphenyl)-5-(5-(trifluoromet...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(c1)C(F)(F)F |r,wU:16.17,(1.08,2.33,;-.25,1.55,;-1.59,2.32,;-1.72,3.92,;-3.05,4.69,;-4.38,3.92,;-4.38,2.38,;-5.72,1.61,;-7.05,2.38,;-3.05,1.61,;-3.05,.07,;-1.81,-.84,;-.47,-.07,;.86,-.84,;.09,-2.17,;1.63,-2.17,;2.2,-.07,;2.2,1.47,;3.53,-.84,;4.86,-.07,;6.2,-.84,;7.53,-.07,;7.53,1.47,;8.86,2.24,;6.2,2.24,;4.86,1.47,;-2.28,-2.3,;-3.82,-2.3,;-4.3,-.84,;-5.78,-.44,;-6.55,.89,;-8.09,.89,;-8.86,-.44,;-8.09,-1.77,;-6.55,-1.77,;-8.86,-3.11,;-10.4,-3.11,;-8.09,-4.44,;-7.32,-3.11,)| Show InChI InChI=1S/C23H21F4N7O4S/c1-13(7-19-29-11-16(24)12-30-19)39(35,36)33-22-32-31-21(14-8-15(10-28-9-14)23(25,26)27)34(22)20-17(37-2)5-4-6-18(20)38-3/h4-6,8-13H,7H2,1-3H3,(H,32,33)/t13-/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 | 66 | 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)) | BDBM269625
((2S)-N-(4-(2,6-dimethoxyphenyl)-5-(3-methoxy-2-pyr...)Show SMILES COc1cccnc1-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:16.17,(-6.58,-4.76,;-5.81,-3.43,;-6.58,-2.1,;-8.12,-2.1,;-8.89,-.76,;-8.12,.57,;-6.58,.57,;-5.81,-.76,;-4.27,-.76,;-3.79,-2.23,;-2.25,-2.23,;-1.78,-.76,;-.45,.01,;.89,-.76,;.12,-2.1,;1.66,-2.1,;2.22,.01,;2.22,1.55,;3.56,-.76,;4.89,.01,;6.22,-.76,;7.56,.01,;7.56,1.55,;8.89,2.32,;6.22,2.32,;4.89,1.55,;-3.02,.14,;-3.02,1.68,;-1.69,2.45,;-.36,1.68,;.98,2.45,;-1.69,3.99,;-3.02,4.76,;-4.36,3.99,;-4.36,2.45,;-5.69,1.68,;-7.03,2.45,)| Show InChI InChI=1S/C23H24FN7O5S/c1-14(11-19-26-12-15(24)13-27-19)37(32,33)30-23-29-28-22(20-16(34-2)9-6-10-25-20)31(23)21-17(35-3)7-5-8-18(21)36-4/h5-10,12-14H,11H2,1-4H3,(H,29,30)/t14-/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 | 110 | 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)) | BDBM269668
((2R,3S)-N-(4-(2,6-dimethoxyphenyl)-5-(3-pyridinyl)...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccnc1 |r,wU:16.17,18.19,(.98,3.12,;-.36,2.35,;-1.69,3.12,;-1.69,4.66,;-3.02,5.43,;-4.36,4.66,;-4.36,3.12,;-5.69,2.35,;-7.03,3.12,;-3.02,2.35,;-3.02,.81,;-1.78,-.1,;-.45,.67,;.89,-.1,;.12,-1.43,;1.66,-1.43,;2.22,.67,;2.22,2.21,;3.56,-.1,;3.56,-1.64,;4.89,.67,;6.22,-.1,;7.56,.67,;7.56,2.21,;8.89,2.98,;6.22,2.98,;4.89,2.21,;-2.25,-1.56,;-3.79,-1.56,;-4.27,-.1,;-5.81,-.1,;-6.58,1.24,;-8.12,1.24,;-8.89,-.1,;-8.12,-1.43,;-6.58,-1.43,)| Show InChI InChI=1S/C23H24FN7O4S/c1-14(21-26-12-17(24)13-27-21)15(2)36(32,33)30-23-29-28-22(16-7-6-10-25-11-16)31(23)20-18(34-3)8-5-9-19(20)35-4/h5-15H,1-4H3,(H,29,30)/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)) | BDBM269710
((2S)-N-(4-(2,6-dimethoxyphenyl)-5-(5-fluoro-3-pyri...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(F)c1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,1.35,;-8.12,1.35,;-8.89,2.68,;-8.12,4.02,;-8.89,5.35,;-6.58,4.02,)| Show InChI InChI=1S/C22H21F2N7O4S/c1-13(7-19-26-11-16(24)12-27-19)36(32,33)30-22-29-28-21(14-8-15(23)10-25-9-14)31(22)20-17(34-2)5-4-6-18(20)35-3/h4-6,8-13H,7H2,1-3H3,(H,29,30)/t13-/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 | 22 | 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)) | BDBM269710
((2S)-N-(4-(2,6-dimethoxyphenyl)-5-(5-fluoro-3-pyri...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cncc(F)c1 |r,wU:16.17,(-7.03,5.9,;-5.69,5.13,;-4.36,5.9,;-4.36,7.44,;-3.02,8.21,;-1.69,7.44,;-1.69,5.9,;-.36,5.13,;.98,5.9,;-3.02,5.13,;-3.02,3.59,;-1.78,2.68,;-.45,3.45,;.89,2.68,;.12,1.35,;1.66,1.35,;2.22,3.45,;2.22,4.99,;3.56,2.68,;4.89,3.45,;6.22,2.68,;7.56,3.45,;7.56,4.99,;8.89,5.76,;6.22,5.76,;4.89,4.99,;-2.25,1.22,;-3.79,1.22,;-4.27,2.68,;-5.81,2.68,;-6.58,1.35,;-8.12,1.35,;-8.89,2.68,;-8.12,4.02,;-8.89,5.35,;-6.58,4.02,)| Show InChI InChI=1S/C22H21F2N7O4S/c1-13(7-19-26-11-16(24)12-27-19)36(32,33)30-22-29-28-21(14-8-15(23)10-25-9-14)31(22)20-17(34-2)5-4-6-18(20)35-3/h4-6,8-13H,7H2,1-3H3,(H,29,30)/t13-/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 | 88 | 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)) | BDBM269713
(6-(4-(2,6-dimethoxyphenyl)-5-((((1S)-2-(5-fluoro-2...)Show SMILES CCNC(=O)c1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)n1-c1c(OC)cccc1OC |r,wU:19.20,(-5.04,2.44,;-5.81,1.1,;-7.35,1.1,;-8.12,2.44,;-9.66,2.44,;-7.35,3.77,;-8.12,5.1,;-7.35,6.44,;-5.81,6.44,;-5.04,5.1,;-5.81,3.77,;-3.5,5.1,;-3.02,3.64,;-1.48,3.64,;-1.01,5.1,;.32,5.87,;1.66,5.1,;.89,3.77,;2.43,3.77,;2.99,5.87,;2.99,7.41,;4.33,5.1,;5.66,5.87,;6.99,5.1,;8.33,5.87,;8.33,7.41,;9.66,8.18,;6.99,8.18,;5.66,7.41,;-2.25,6.01,;-2.25,7.55,;-3.59,8.32,;-4.92,7.55,;-6.26,8.32,;-3.59,9.86,;-2.25,10.63,;-.92,9.86,;-.92,8.32,;.41,7.55,;1.75,8.32,)| Show InChI InChI=1S/C25H27FN8O5S/c1-5-27-24(35)18-9-6-8-17(30-18)23-31-32-25(34(23)22-19(38-3)10-7-11-20(22)39-4)33-40(36,37)15(2)12-21-28-13-16(26)14-29-21/h6-11,13-15H,5,12H2,1-4H3,(H,27,35)(H,32,33)/t15-/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 | 5.30 | 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)) | BDBM269717
(6-(4-(2,6-dimethoxyphenyl)-5-((((1S)-2-(5-fluoro-2...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)Cc2ncc(F)cn2)nnc1-c1cccc(n1)C(=O)N(C)C |r,wU:16.17,(-6.26,9.27,;-4.92,8.5,;-3.59,9.27,;-3.59,10.81,;-2.25,11.58,;-.92,10.81,;-.92,9.27,;.41,8.5,;1.75,9.27,;-2.25,8.5,;-2.25,6.96,;-1.01,6.05,;.32,6.82,;1.66,6.05,;.89,4.72,;2.43,4.72,;2.99,6.82,;2.99,8.36,;4.33,6.05,;5.66,6.82,;6.99,6.05,;8.33,6.82,;8.33,8.36,;9.66,9.13,;6.99,9.13,;5.66,8.36,;-1.48,4.59,;-3.02,4.59,;-3.5,6.05,;-5.04,6.05,;-5.81,7.39,;-7.35,7.39,;-8.12,6.05,;-7.35,4.72,;-5.81,4.72,;-8.12,3.39,;-9.66,3.39,;-7.35,2.05,;-5.81,2.05,;-8.12,.72,)| Show InChI InChI=1S/C25H27FN8O5S/c1-15(12-21-27-13-16(26)14-28-21)40(36,37)32-25-31-30-23(17-8-6-9-18(29-17)24(35)33(2)3)34(25)22-19(38-4)10-7-11-20(22)39-5/h6-11,13-15H,12H2,1-5H3,(H,31,32)/t15-/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 | 11 | 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)) | BDBM269730
((1R,2S)-1-(4-cyanophenyl)-N-(4-(2,6-dimethoxypheny...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-7.69,5.81,;-6.36,5.04,;-5.03,5.81,;-5.03,7.35,;-3.69,8.12,;-2.36,7.35,;-2.36,5.81,;-1.02,5.04,;.31,5.81,;-3.69,5.04,;-3.69,3.5,;-2.45,2.6,;-1.11,3.37,;.22,2.6,;-.55,1.26,;.99,1.26,;1.56,3.37,;1.56,4.91,;2.89,2.6,;2.89,1.06,;4.22,3.37,;5.56,2.6,;6.89,3.37,;6.94,4.94,;5.56,5.68,;4.22,4.91,;8.27,5.71,;9.6,6.48,;-2.92,1.13,;-4.46,1.13,;-4.94,2.6,;-6.48,2.6,;-7.25,1.26,;-8.79,1.26,;-9.56,2.6,;-8.79,3.93,;-9.56,5.27,;-7.25,3.93,)| Show InChI InChI=1S/C26H26N6O5S/c1-16-12-20(15-28-14-16)25-29-30-26(32(25)23-21(36-3)6-5-7-22(23)37-4)31-38(34,35)17(2)24(33)19-10-8-18(13-27)9-11-19/h5-12,14-15,17,24,33H,1-4H3,(H,30,31)/t17-,24-/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 | 3.80 | 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)) | BDBM269731
((1R,2S)-1-(4-cyanophenyl)-N-(4-(2,6-dimethoxypheny...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](O)c2ccc(cc2)C#N)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(-7.69,5.92,;-6.36,5.15,;-5.03,5.92,;-5.03,7.46,;-3.69,8.23,;-2.36,7.46,;-2.36,5.92,;-1.02,5.15,;.31,5.92,;-3.69,5.15,;-3.69,3.61,;-2.45,2.71,;-1.11,3.48,;.22,2.71,;-.55,1.37,;.99,1.37,;1.56,3.48,;1.56,5.02,;2.89,2.71,;2.89,1.17,;4.22,3.48,;5.56,2.71,;6.89,3.48,;6.94,5.04,;5.56,5.79,;4.22,5.02,;8.27,5.82,;9.6,6.59,;-2.92,1.24,;-4.46,1.24,;-4.94,2.71,;-6.48,2.71,;-7.25,1.37,;-8.79,1.37,;-9.56,2.71,;-8.79,4.04,;-9.56,5.37,;-7.25,4.04,)| Show InChI InChI=1S/C26H26N6O5S/c1-16-12-20(15-28-14-16)25-29-30-26(32(25)23-21(36-3)6-5-7-22(23)37-4)31-38(34,35)17(2)24(33)19-10-8-18(13-27)9-11-19/h5-12,14-15,17,24,33H,1-4H3,(H,30,31)/t17-,24-/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 | 60 | 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)) | BDBM269735
((1R,2S)-N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3-p...)Show SMILES CCO[C@@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:4.4,3.2,(4.79,-4.69,;4.79,-3.15,;3.45,-2.38,;3.45,-.84,;2.12,-.07,;2.12,1.47,;.79,-.84,;.02,-2.17,;1.56,-2.17,;-.55,-.07,;-1.88,-.84,;-2.36,-2.3,;-3.9,-2.3,;-4.37,-.84,;-5.71,-.07,;-6.48,-1.4,;-8.02,-1.4,;-8.79,-.07,;-8.02,1.27,;-8.79,2.6,;-6.48,1.27,;-3.13,.07,;-3.13,1.61,;-1.72,2.29,;-.4,1.51,;.95,2.26,;-1.79,3.92,;-3.13,4.69,;-4.46,3.92,;-4.46,2.38,;-5.8,1.61,;-7.13,2.38,;4.79,-.07,;6.12,-.84,;7.45,-.07,;7.45,1.47,;8.79,2.24,;6.12,2.24,;4.79,1.47,)| Show InChI InChI=1S/C26H31N7O5S/c1-7-38-23(24-28-13-17(3)14-29-24)18(4)39(34,35)32-26-31-30-25(19-11-16(2)12-27-15-19)33(26)22-20(36-5)9-8-10-21(22)37-6/h8-15,18,23H,7H2,1-6H3,(H,31,32)/t18-,23-/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 | 0.800 | 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)) | BDBM269756
((R)-2-(2-cyano-4-fluorophenyl)-N-(4-(2,6-dimethoxy...)Show SMILES CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cc1C#N |r,wD:2.1,(2.31,-9.47,;3.65,-8.7,;3.65,-7.16,;2.31,-6.39,;.98,-7.16,;-.11,-8.24,;1.38,-8.64,;-.11,-6.07,;-1.6,-6.47,;-2.07,-7.93,;-3.61,-7.93,;-4.09,-6.47,;-5.58,-6.07,;-5.98,-4.58,;-7.46,-4.18,;-8.55,-5.27,;-8.15,-6.76,;-9.24,-7.85,;-8.84,-9.33,;-6.67,-7.16,;-2.84,-5.56,;-2.84,-3.54,;-4.18,-2.77,;-5.51,-3.54,;-6.84,-2.77,;-4.18,-1.23,;-2.84,-.46,;-1.51,-1.23,;-1.51,-2.77,;-.18,-3.54,;1.16,-2.77,;4.98,-6.39,;4.98,-4.85,;6.31,-4.08,;7.65,-4.85,;8.98,-4.08,;7.65,-6.39,;6.31,-7.21,;6.31,-8.75,;6.31,-10.29,)| Show InChI InChI=1S/C26H25FN6O6S/c1-36-20-8-6-9-21(37-2)24(20)33-25(19-7-5-10-23(29-19)39-4)30-31-26(33)32-40(34,35)15-22(38-3)18-12-11-17(27)13-16(18)14-28/h5-13,22H,15H2,1-4H3,(H,31,32)/t22-/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 | 0.370 | 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)) | BDBM269763
((1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2ccc(F)cc2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-9.25,-20.18,;-8.85,-18.69,;-7.36,-18.3,;-6.96,-16.81,;-5.47,-16.41,;-4.39,-17.5,;-4.78,-18.99,;-6.27,-19.38,;-3.7,-20.08,;-3.7,-21.62,;-2.23,-22.09,;-1.33,-20.85,;.21,-20.85,;.98,-22.18,;1.75,-23.51,;-.35,-22.95,;2.32,-21.41,;2.32,-19.87,;3.65,-22.18,;3.65,-23.72,;4.99,-21.41,;6.32,-22.18,;7.65,-21.41,;7.65,-19.87,;8.99,-19.1,;6.32,-19.1,;4.99,-19.87,;-2.23,-19.6,;-1.47,-16.75,;-2.56,-15.66,;-4.04,-16.06,;-5.13,-14.97,;-2.16,-14.17,;-.67,-13.77,;.42,-14.86,;.02,-16.35,;1.11,-17.44,;2.6,-17.04,)| Show InChI InChI=1S/C25H26FN5O6S/c1-15(23(32)16-11-13-17(26)14-12-16)38(33,34)30-25-29-28-24(18-7-5-10-21(27-18)37-4)31(25)22-19(35-2)8-6-9-20(22)36-3/h5-15,23,32H,1-4H3,(H,29,30)/t15-,23+/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 | 0.680 | 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)) | BDBM269767
((1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@H](C)[C@H](O)c2ccc(F)cc2Br)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(2.02,-10.37,;1.62,-8.88,;2.71,-7.79,;2.31,-6.3,;3.4,-5.21,;4.89,-5.61,;5.28,-7.1,;4.19,-8.19,;6.77,-7.5,;7.25,-8.96,;8.79,-8.96,;9.26,-7.5,;10.75,-7.1,;11.52,-5.77,;13.01,-5.37,;13.41,-3.88,;12.32,-2.79,;14.89,-3.48,;13.81,-2.39,;12.08,-7.87,;12.85,-9.2,;11.31,-9.2,;13.42,-7.1,;13.42,-5.56,;14.75,-7.87,;14.75,-9.41,;16.09,-7.1,;16.09,-5.56,;17.42,-4.79,;18.75,-5.56,;20.09,-4.79,;18.75,-7.1,;17.42,-7.87,;17.42,-9.41,;8.02,-6.59,;8.02,-5.05,;6.68,-4.28,;5.35,-5.05,;4.02,-4.28,;6.68,-2.74,;8.02,-1.97,;9.35,-2.74,;9.35,-4.28,;10.68,-5.05,;12.02,-4.28,)| Show InChI InChI=1S/C30H37BrFN5O6SSi/c1-19(28(38)21-15-14-20(32)18-22(21)31)44(39,40)36(16-17-45(5,6)7)30-35-34-29(23-10-8-13-26(33-23)43-4)37(30)27-24(41-2)11-9-12-25(27)42-3/h8-15,18-19,28,38H,16-17H2,1-7H3/t19-,28+/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 | 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)) | BDBM269805
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-...)Show SMILES CO[C@H](CS(=O)(=O)N(CC[Si](C)(C)C)c1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:2.1,(7.55,-13.31,;6.01,-13.31,;5.24,-11.97,;3.7,-11.97,;2.93,-13.31,;2.16,-14.64,;4.26,-14.08,;1.59,-12.54,;1.59,-11,;2.93,-10.23,;2.93,-8.69,;4.47,-8.69,;1.46,-8.21,;2.93,-7.15,;.26,-13.31,;.26,-14.85,;-1.21,-15.32,;-2.11,-14.08,;-3.6,-13.68,;-4,-12.19,;-5.48,-11.79,;-6.57,-12.88,;-6.17,-14.37,;-7.26,-15.46,;-6.87,-16.95,;-4.69,-14.77,;-1.21,-12.83,;-1.78,-10.69,;-.69,-9.6,;.8,-10,;1.89,-8.91,;-1.09,-8.11,;-2.58,-7.71,;-3.67,-8.8,;-3.27,-10.29,;-4.36,-11.38,;-5.84,-10.98,;6.01,-10.64,;5.24,-9.31,;6.01,-7.97,;7.55,-7.97,;8.32,-6.64,;8.32,-9.31,;7.55,-10.64,)| Show InChI InChI=1S/C29H37FN6O6SSi/c1-39-23-11-9-12-24(40-2)27(23)36-28(22-10-8-13-26(32-22)42-4)33-34-29(36)35(16-17-44(5,6)7)43(37,38)19-25(41-3)21-15-14-20(30)18-31-21/h8-15,18,25H,16-17,19H2,1-7H3/t25-/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 | 0.330 | 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)) | BDBM269806
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-...)Show SMILES CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(F)cn1 |r,wD:2.1,(7.77,-13.93,;6.23,-13.93,;5.46,-12.6,;3.92,-12.6,;3.15,-13.93,;2.38,-15.26,;4.49,-14.7,;1.82,-13.16,;.49,-13.93,;.49,-15.47,;-.98,-15.95,;-1.88,-14.7,;-3.37,-14.3,;-3.77,-12.81,;-5.26,-12.42,;-6.35,-13.5,;-5.95,-14.99,;-7.04,-16.08,;-6.64,-17.57,;-4.46,-15.39,;-.98,-13.45,;-1.55,-11.31,;-.46,-10.22,;1.02,-10.62,;2.11,-9.53,;-.86,-8.74,;-2.35,-8.34,;-3.44,-9.43,;-3.04,-10.91,;-4.13,-12,;-5.62,-11.6,;6.23,-11.26,;5.46,-9.93,;6.23,-8.6,;7.77,-8.6,;8.54,-7.26,;8.54,-9.93,;7.77,-11.26,)| Show InChI InChI=1S/C24H25FN6O6S/c1-34-18-8-6-9-19(35-2)22(18)31-23(17-7-5-10-21(27-17)37-4)28-29-24(31)30-38(32,33)14-20(36-3)16-12-11-15(25)13-26-16/h5-13,20H,14H2,1-4H3,(H,29,30)/t20-/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 | 0.300 | 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)) | BDBM269809
((R)-2-(5-cyanopyridin-2-yl)-N-(4-(2,6-dimethoxyphe...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ccc(cn2)C#N)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.37,-18.24,;-7.77,-16.75,;-6.68,-15.66,;-7.08,-14.17,;-5.99,-13.08,;-4.5,-13.48,;-4.1,-14.97,;-5.19,-16.06,;-2.62,-15.37,;-1.71,-16.61,;-.25,-16.14,;-.25,-14.6,;1.09,-13.83,;2.42,-14.6,;1.65,-15.93,;3.75,-15.37,;3.19,-13.26,;4.73,-13.26,;5.5,-14.6,;5.5,-11.93,;4.73,-10.6,;5.5,-9.26,;7.07,-9.21,;7.81,-10.6,;7.04,-11.93,;7.84,-7.88,;8.61,-6.55,;-1.71,-14.12,;-2.29,-11.98,;-1.2,-10.89,;.29,-11.29,;1.38,-10.2,;-1.6,-9.4,;-3.08,-9,;-4.17,-10.09,;-3.77,-11.58,;-4.86,-12.67,;-6.35,-12.27,)| Show InChI InChI=1S/C24H23N7O6S/c1-35-19-7-5-8-20(36-2)22(19)31-23(17-6-4-9-21(27-17)37-3)28-29-24(31)30-38(33,34)14-18(32)16-11-10-15(12-25)13-26-16/h4-11,13,18,32H,14H2,1-3H3,(H,29,30)/t18-/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 | 0.580 | 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)) | BDBM269818
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-...)Show SMILES CCc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2ncc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-7.68,-9.32,;-8.08,-7.83,;-6.99,-6.75,;-7.39,-5.26,;-6.3,-4.17,;-4.82,-4.57,;-4.42,-6.06,;-5.51,-7.14,;-2.93,-6.45,;-2.45,-7.92,;-.91,-7.92,;-.44,-6.45,;1.05,-6.06,;2.14,-7.14,;1.05,-8.23,;3.23,-8.23,;3.23,-6.06,;4.71,-6.45,;5.11,-7.94,;5.8,-5.36,;7.29,-5.76,;8.38,-4.67,;7.98,-3.19,;9.07,-2.1,;6.49,-2.79,;5.4,-3.88,;-1.68,-5.55,;-1.68,-4.01,;-3.02,-3.24,;-4.35,-4.01,;-5.69,-3.24,;-3.02,-1.7,;-1.68,-.93,;-.35,-1.7,;-.35,-3.24,;.98,-4.01,;2.32,-3.24,)| Show InChI InChI=1S/C24H27N7O5S/c1-5-16-8-6-9-17(27-16)23-28-29-24(31(23)21-19(35-3)10-7-11-20(21)36-4)30-37(33,34)14-18(32)22-25-12-15(2)13-26-22/h6-13,18,32H,5,14H2,1-4H3,(H,29,30)/t18-/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 | 0.75 | 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)) | BDBM269820
((1S,2S)-1-(4-cyano-2-fluorophenyl)-N-(4-(2,6-dimet...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](O)c2ccc(cc2F)C#N)nnc1-c1cncc(C)c1 |r,wD:16.17,18.19,(-6.23,-12.46,;-4.9,-13.23,;-3.56,-12.46,;-3.56,-10.92,;-2.23,-10.15,;-.9,-10.92,;-.9,-12.46,;.44,-13.23,;1.77,-12.46,;-2.23,-13.23,;-2.23,-14.77,;-.99,-15.68,;.5,-15.28,;1.59,-16.37,;.5,-17.46,;2.68,-17.46,;2.68,-15.28,;2.28,-13.79,;4.17,-15.68,;4.57,-17.17,;5.26,-14.59,;6.74,-14.99,;7.83,-13.9,;7.47,-12.37,;5.95,-12.01,;4.86,-13.1,;3.37,-12.7,;8.56,-11.28,;9.65,-10.2,;-1.46,-17.14,;-3,-17.14,;-3.48,-15.68,;-4.96,-15.28,;-5.36,-13.79,;-6.85,-13.39,;-7.94,-14.48,;-7.54,-15.97,;-8.63,-17.06,;-6.05,-16.37,)| Show InChI InChI=1S/C26H25FN6O5S/c1-15-10-18(14-29-13-15)25-30-31-26(33(25)23-21(37-3)6-5-7-22(23)38-4)32-39(35,36)16(2)24(34)19-9-8-17(12-28)11-20(19)27/h5-11,13-14,16,24,34H,1-4H3,(H,31,32)/t16-,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 | 64 | 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)) | BDBM269825
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl-3...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)C[C@H](O)c2ccc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:17.18,(-5.43,-3.31,;-4.1,-4.08,;-2.76,-3.31,;-2.76,-1.77,;-1.43,-1,;-.1,-1.77,;-.1,-3.31,;1.24,-4.08,;2.57,-3.31,;-1.43,-4.08,;-1.43,-5.62,;-.18,-6.53,;1.3,-6.13,;2.39,-7.22,;1.3,-8.31,;3.48,-8.31,;3.48,-6.13,;4.97,-6.53,;5.37,-8.02,;6.06,-5.44,;5.66,-3.95,;6.75,-2.86,;8.24,-3.26,;9.32,-2.17,;8.63,-4.75,;7.55,-5.84,;-.66,-7.99,;-2.2,-7.99,;-2.68,-6.53,;-4.16,-6.13,;-4.56,-4.64,;-6.05,-4.24,;-7.14,-5.33,;-6.74,-6.82,;-7.83,-7.91,;-5.25,-7.22,)| Show InChI InChI=1S/C23H23FN6O5S/c1-14-9-15(11-25-10-14)22-27-28-23(30(22)21-19(34-2)5-4-6-20(21)35-3)29-36(32,33)13-18(31)17-8-7-16(24)12-26-17/h4-12,18,31H,13H2,1-3H3,(H,28,29)/t18-/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 | 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)) | BDBM269842
((1R,2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES CO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(F)cn1 |r,wU:3.3,wD:2.1,(2.52,-13.99,;3.85,-13.22,;3.85,-11.68,;2.52,-10.91,;2.52,-9.37,;1.19,-11.68,;.42,-13.01,;1.96,-13.01,;-.15,-10.91,;-1.48,-11.68,;-1.96,-13.14,;-3.5,-13.14,;-3.97,-11.68,;-5.31,-10.91,;-6.08,-9.57,;-7.62,-9.57,;-8.39,-10.91,;-7.62,-12.24,;-8.39,-13.58,;-9.93,-13.58,;-6.08,-12.24,;-2.73,-10.77,;-2.73,-8.87,;-1.35,-8.13,;-.01,-8.9,;1.32,-8.13,;-1.39,-6.56,;-2.73,-5.79,;-4.06,-6.56,;-4.06,-8.1,;-5.39,-8.87,;-6.73,-8.1,;5.19,-10.91,;6.52,-11.68,;7.85,-10.91,;7.85,-9.37,;9.19,-8.6,;6.52,-8.6,;5.19,-9.37,)| Show InChI InChI=1S/C24H26FN7O6S/c1-14(21(38-5)22-26-12-15(25)13-27-22)39(33,34)31-24-30-29-23(16-8-6-11-19(28-16)37-4)32(24)20-17(35-2)9-7-10-18(20)36-3/h6-14,21H,1-5H3,(H,30,31)/t14-,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 | 31 | 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)) | BDBM269845
(2-(4-chlorophenyl)-N-(4-(2,6-dimethoxyphenyl)-5-(2...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)CCc2ccc(Cl)cc2)nnc1-c1ccccn1 |(1.32,-8.51,;-.01,-9.28,;-1.35,-8.51,;-1.39,-6.95,;-2.73,-6.18,;-4.06,-6.95,;-4.06,-8.49,;-5.39,-9.26,;-6.73,-8.49,;-2.73,-9.26,;-2.73,-11.16,;-1.48,-12.06,;-.15,-11.29,;1.19,-12.06,;.42,-13.4,;1.96,-13.4,;2.52,-11.29,;3.85,-12.06,;5.19,-11.29,;6.52,-12.06,;7.85,-11.29,;7.85,-9.75,;9.19,-8.98,;6.52,-8.98,;5.19,-9.75,;-1.96,-13.53,;-3.5,-13.53,;-3.97,-12.06,;-5.31,-11.29,;-6.08,-9.96,;-7.62,-9.96,;-8.39,-11.29,;-7.62,-12.63,;-6.08,-12.63,)| Show InChI InChI=1S/C23H22ClN5O4S/c1-32-19-7-5-8-20(33-2)21(19)29-22(18-6-3-4-14-25-18)26-27-23(29)28-34(30,31)15-13-16-9-11-17(24)12-10-16/h3-12,14H,13,15H2,1-2H3,(H,27,28) | 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 | 59 | 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)) | BDBM269873
((1S,2R)—N-(4-(2,6-dimethoxyphenyl)-5-(5-methy...)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,wD:21.23,(1.36,-14.72,;.03,-15.49,;-1.3,-14.72,;-1.35,-13.15,;-2.69,-12.38,;-4.02,-13.15,;-4.02,-14.69,;-5.35,-15.46,;-6.69,-14.69,;-2.69,-15.46,;-2.69,-17,;-1.44,-17.9,;-.11,-17.13,;1.23,-17.9,;.46,-19.24,;2,-19.24,;2.56,-17.13,;2.56,-15.59,;3.89,-17.9,;3.89,-19.44,;5.23,-20.21,;5.23,-21.75,;6.56,-22.52,;3.89,-22.52,;5.23,-17.13,;6.56,-17.9,;7.9,-17.13,;7.9,-15.59,;9.23,-14.82,;6.56,-14.82,;5.23,-15.59,;-1.92,-19.37,;-3.46,-19.37,;-3.93,-17.9,;-5.34,-17.42,;-6.11,-18.76,;-7.65,-18.76,;-8.42,-17.42,;-7.65,-16.09,;-8.42,-14.76,;-6.11,-16.09,)| 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-/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 | 17 | 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)) | BDBM269877
((1S,2R)—N-(4-(2,6-dimethoxyphenyl)-5-(5-methy...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](OCC(C)(C)O)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:16.17,18.19,(1.36,-2.62,;.02,-3.39,;-1.31,-2.62,;-1.36,-1.05,;-2.69,-.28,;-4.03,-1.05,;-4.03,-2.59,;-5.36,-3.36,;-6.69,-2.59,;-2.69,-3.36,;-2.69,-4.9,;-1.45,-5.81,;-.11,-5.04,;1.22,-5.81,;.45,-7.14,;1.99,-7.14,;2.55,-5.04,;2.55,-3.5,;3.89,-5.81,;3.89,-7.35,;5.22,-8.12,;5.22,-9.66,;6.56,-10.43,;5.22,-11.2,;3.89,-10.43,;5.22,-5.04,;6.56,-5.81,;7.89,-5.04,;7.89,-3.5,;9.22,-2.73,;6.56,-2.73,;5.22,-3.5,;-1.92,-7.27,;-3.46,-7.27,;-3.94,-5.81,;-5.34,-5.33,;-6.11,-6.66,;-7.65,-6.66,;-8.42,-5.33,;-7.65,-3.99,;-8.42,-2.66,;-6.11,-3.99,)| Show InChI InChI=1S/C28H35N7O6S/c1-17-11-20(15-29-12-17)26-32-33-27(35(26)23-21(39-6)9-8-10-22(23)40-7)34-42(37,38)19(3)24(41-16-28(4,5)36)25-30-13-18(2)14-31-25/h8-15,19,24,36H,16H2,1-7H3,(H,33,34)/t19-,24-/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 | 0.690 | 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)) | BDBM269879
((1S,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(5-methy...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@H](OCCO)c2ncc(C)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,wD:16.17,(1.36,-2.94,;.02,-3.71,;-1.31,-2.94,;-1.36,-1.37,;-2.69,-.6,;-4.03,-1.37,;-4.03,-2.91,;-5.36,-3.68,;-6.69,-2.91,;-2.69,-3.68,;-2.69,-5.22,;-1.45,-6.13,;-.11,-5.36,;1.22,-6.13,;.45,-7.46,;1.99,-7.46,;2.55,-5.36,;2.55,-3.82,;3.89,-6.13,;3.89,-7.67,;5.22,-8.44,;5.22,-9.98,;6.56,-10.75,;5.22,-5.36,;6.56,-6.13,;7.89,-5.36,;7.89,-3.82,;9.22,-3.05,;6.56,-3.05,;5.22,-3.82,;-1.92,-7.59,;-3.46,-7.59,;-3.94,-6.13,;-5.34,-5.64,;-6.11,-6.98,;-7.65,-6.98,;-8.42,-5.64,;-7.65,-4.31,;-8.42,-2.98,;-6.11,-4.31,)| Show InChI InChI=1S/C26H31N7O6S/c1-16-11-19(15-27-12-16)25-30-31-26(33(25)22-20(37-4)7-6-8-21(22)38-5)32-40(35,36)18(3)23(39-10-9-34)24-28-13-17(2)14-29-24/h6-8,11-15,18,23,34H,9-10H2,1-5H3,(H,31,32)/t18-,23+/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 | 29 | 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)) | BDBM269883
(1S,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(5-methyl...)Show SMILES COCCO[C@H]([C@H](C)S(=O)(=O)Nc1nnc(-c2cncc(C)c2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:6.6,wD:5.4,(6.48,-13.22,;6.48,-11.68,;5.14,-10.91,;5.14,-9.37,;3.81,-8.6,;3.81,-7.06,;2.48,-6.29,;2.48,-4.75,;1.14,-7.06,;1.91,-8.39,;.37,-8.39,;-.19,-6.29,;-1.52,-7.06,;-2,-8.52,;-3.54,-8.52,;-4.02,-7.06,;-5.35,-6.29,;-6.12,-7.62,;-7.66,-7.62,;-8.43,-6.29,;-7.66,-4.95,;-8.43,-3.62,;-6.12,-4.95,;-2.77,-6.15,;-2.77,-4.43,;-1.39,-3.69,;-.05,-4.46,;1.28,-3.69,;-1.44,-2.12,;-2.77,-1.35,;-4.1,-2.12,;-4.1,-3.66,;-5.44,-4.43,;-6.77,-3.66,;5.14,-6.29,;5.14,-4.75,;6.48,-3.98,;7.81,-4.75,;9.15,-3.98,;7.81,-6.29,;6.48,-7.06,)| Show InChI InChI=1S/C27H33N7O6S/c1-17-12-20(16-28-13-17)26-31-32-27(34(26)23-21(38-5)8-7-9-22(23)39-6)33-41(35,36)19(3)24(40-11-10-37-4)25-29-14-18(2)15-30-25/h7-9,12-16,19,24H,10-11H2,1-6H3,(H,32,33)/t19-,24+/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 | 0.460 | 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)) | BDBM269890
((1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES CN[C@@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)cn1 |r,wU:2.1,wD:3.3,(3.39,-18.18,;4.66,-17.45,;4.66,-15.91,;3.33,-15.14,;3.33,-13.6,;2,-15.91,;1.23,-17.24,;2.77,-17.24,;.66,-15.14,;-.67,-15.91,;-1.15,-17.37,;-2.69,-17.37,;-3.16,-15.91,;-4.7,-15.91,;-5.47,-14.57,;-7.01,-14.57,;-7.78,-15.91,;-7.01,-17.24,;-7.78,-18.57,;-9.32,-18.57,;-5.47,-17.24,;-1.92,-15,;-1.92,-13.46,;-.58,-12.69,;.75,-13.46,;2.08,-12.69,;-.58,-11.15,;-1.92,-10.38,;-3.25,-11.15,;-3.25,-12.69,;-4.58,-13.46,;-5.92,-12.69,;6,-15.14,;7.33,-15.91,;8.66,-15.14,;8.66,-13.6,;10,-12.83,;7.33,-12.83,;6,-13.6,)| Show InChI InChI=1S/C25H30N8O5S/c1-15-13-27-23(28-14-15)21(26-3)16(2)39(34,35)32-25-31-30-24(17-9-7-12-20(29-17)38-6)33(25)22-18(36-4)10-8-11-19(22)37-5/h7-14,16,21,26H,1-6H3,(H,31,32)/t16-,21+/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 | 0.440 | 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)) | BDBM269908
((2R,3S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...)Show SMILES COc1cccc(n1)-c1nnc(N(CC[Si](C)(C)C)S(=O)(=O)[C@@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wU:24.25,wD:22.23,(-9.02,-22.05,;-7.54,-22.45,;-6.45,-21.36,;-6.85,-19.88,;-5.76,-18.79,;-4.27,-19.19,;-3.87,-20.67,;-4.96,-21.76,;-2.38,-21.07,;-1.91,-22.54,;-.37,-22.54,;.11,-21.07,;1.44,-20.3,;1.44,-18.76,;2.78,-17.99,;2.78,-15.37,;1.44,-14.6,;4.39,-14.6,;2.78,-13.83,;2.78,-21.07,;2.01,-22.41,;3.55,-19.74,;4.11,-21.84,;4.11,-23.38,;5.44,-21.07,;5.44,-19.53,;6.78,-21.84,;6.78,-23.38,;8.11,-24.15,;9.44,-23.38,;9.44,-21.84,;8.11,-21.07,;-1.14,-20.17,;-1.86,-17.81,;-3.35,-17.41,;-4.44,-18.5,;-5.93,-18.11,;-3.75,-15.93,;-2.66,-14.84,;-1.17,-15.24,;-.77,-16.72,;.71,-17.12,;1.8,-16.03,)| Show InChI InChI=1S/C30H45N5O6SSi/c1-21(28(36)22-13-9-8-10-14-22)42(37,38)34(19-20-43(5,6)7)30-33-32-29(23-15-11-18-26(31-23)41-4)35(30)27-24(39-2)16-12-17-25(27)40-3/h11-12,15-18,21-22,28,36H,8-10,13-14,19-20H2,1-7H3/t21-,28+/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| KEGG
PC cid
PC sid
UniChem
| US Patent
| n/a | n/a | n/a | n/a | 1.20 | 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)) | BDBM269914
((1S,2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.92,-8.96,;-7.43,-9.36,;-6.34,-8.27,;-6.74,-6.78,;-5.65,-5.69,;-4.16,-6.09,;-3.76,-7.58,;-4.85,-8.67,;-2.27,-7.98,;-1.8,-9.44,;-.26,-9.44,;.22,-7.98,;1.55,-7.21,;2.88,-7.98,;2.11,-9.31,;3.65,-9.31,;4.22,-7.21,;4.22,-5.67,;5.55,-7.98,;5.55,-9.52,;6.89,-7.21,;8.22,-7.98,;9.55,-7.21,;9.55,-5.67,;8.22,-4.9,;6.89,-5.67,;-1.03,-7.07,;-1.03,-5.53,;-2.36,-4.76,;-3.7,-5.53,;-5.03,-4.76,;-2.36,-3.22,;-1.03,-2.45,;.3,-3.22,;.3,-4.76,;1.64,-5.53,;2.97,-4.76,)| Show InChI InChI=1S/C24H31N5O7S/c1-15(22(30)16-11-13-36-14-12-16)37(31,32)28-24-27-26-23(17-7-5-10-20(25-17)35-4)29(24)21-18(33-2)8-6-9-19(21)34-3/h5-10,15-16,22,30H,11-14H2,1-4H3,(H,27,28)/t15-,22-/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 | 29 | 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)) | BDBM269913
((1S,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@H](O)C2CCOCC2)n1-c1c(OC)cccc1OC |r,wU:18.19,wD:16.17,(-8.89,-8.11,;-7.41,-8.51,;-6.32,-7.42,;-6.71,-5.94,;-5.63,-4.85,;-4.14,-5.25,;-3.74,-6.73,;-4.83,-7.82,;-2.25,-7.13,;-1.78,-8.6,;-.24,-8.6,;.24,-7.13,;1.57,-6.36,;2.91,-7.13,;3.68,-8.47,;2.14,-8.47,;4.24,-6.36,;4.24,-4.82,;5.57,-7.13,;5.57,-8.67,;6.91,-6.36,;8.24,-7.13,;9.58,-6.36,;9.58,-4.82,;8.24,-4.05,;6.91,-4.82,;-1.01,-6.23,;-1.01,-4.69,;-2.34,-3.92,;-3.67,-4.69,;-5.01,-3.92,;-2.34,-2.38,;-1.01,-1.61,;.33,-2.38,;.33,-3.92,;1.66,-4.69,;2.99,-3.92,)| Show InChI InChI=1S/C24H31N5O7S/c1-15(22(30)16-11-13-36-14-12-16)37(31,32)28-24-27-26-23(17-7-5-10-20(25-17)35-4)29(24)21-18(33-2)8-6-9-19(21)34-3/h5-10,15-16,22,30H,11-14H2,1-4H3,(H,27,28)/t15-,22+/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 | 14 | 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)) | BDBM269916
((2S,3R)—N-(4-(4,6-dimethoxy-5-pyrimidinyl)-5-...)Show SMILES COc1ncnc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cncc(C)c1 |r,wU:18.19,16.17,(2.17,-4.02,;1.08,-5.11,;-.4,-4.71,;-.8,-3.23,;-2.29,-2.83,;-3.38,-3.92,;-2.98,-5.4,;-4.07,-6.49,;-5.56,-6.09,;-1.49,-5.8,;-1.09,-7.29,;.37,-7.77,;1.7,-7,;3.04,-7.77,;2.27,-9.1,;4.37,-8.54,;3.81,-6.43,;3.04,-5.1,;5.35,-6.43,;6.12,-7.77,;6.12,-5.1,;7.66,-5.1,;8.43,-3.76,;7.66,-2.43,;8.43,-1.1,;6.12,-2.43,;5.35,-3.76,;.37,-9.31,;-1.09,-9.78,;-2,-8.54,;-3.54,-8.54,;-4.31,-7.2,;-5.85,-7.2,;-6.62,-8.54,;-5.85,-9.87,;-6.62,-11.2,;-4.31,-9.87,)| Show InChI InChI=1S/C22H24FN9O4S/c1-12-6-15(8-24-7-12)19-29-30-22(32(19)17-20(35-4)27-11-28-21(17)36-5)31-37(33,34)14(3)13(2)18-25-9-16(23)10-26-18/h6-11,13-14H,1-5H3,(H,30,31)/t13-,14-/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 | 4.90 | 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)) | BDBM269919
((2S,3R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methy...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@H](C)[C@@H](C)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wD:18.19,16.17,(2.17,-4.02,;1.08,-5.11,;-.4,-4.71,;-.8,-3.23,;-2.29,-2.83,;-3.38,-3.92,;-2.98,-5.4,;-4.07,-6.49,;-5.56,-6.09,;-1.49,-5.8,;-1.09,-7.29,;.37,-7.77,;1.7,-7,;3.04,-7.77,;2.27,-9.1,;4.37,-8.54,;3.81,-6.43,;3.04,-5.1,;5.35,-6.43,;6.12,-7.77,;6.12,-5.1,;7.66,-5.1,;8.43,-3.76,;7.66,-2.43,;8.43,-1.1,;6.12,-2.43,;5.35,-3.76,;.37,-9.31,;-1.09,-9.78,;-2,-8.54,;-3.54,-8.54,;-4.31,-7.2,;-5.85,-7.2,;-6.62,-8.54,;-5.85,-9.87,;-6.62,-11.2,;-4.31,-9.87,)| Show InChI InChI=1S/C24H26FN7O4S/c1-14-8-6-9-18(28-14)23-29-30-24(32(23)21-19(35-4)10-7-11-20(21)36-5)31-37(33,34)16(3)15(2)22-26-12-17(25)13-27-22/h6-13,15-16H,1-5H3,(H,30,31)/t15-,16-/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 | 1 | 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)) | BDBM269920
((2S,3R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methy...)Show SMILES COc1cccc(OC)c1-n1c(NS(=O)(=O)[C@@H](C)[C@H](C)c2ncc(F)cn2)nnc1-c1cccc(C)n1 |r,wU:18.19,16.17,(1.27,2.13,;.18,1.04,;-1.31,1.44,;-1.71,2.92,;-3.19,3.32,;-4.28,2.23,;-3.88,.75,;-4.97,-.34,;-6.46,.06,;-2.4,.35,;-2,-1.14,;-.53,-1.62,;.8,-.85,;2.13,-1.62,;1.36,-2.95,;3.47,-2.39,;2.9,-.28,;2.13,1.05,;4.44,-.28,;5.21,-1.62,;5.21,1.05,;6.75,1.05,;7.52,2.39,;6.75,3.72,;7.52,5.05,;5.21,3.72,;4.44,2.39,;-.53,-3.16,;-2,-3.63,;-2.9,-2.39,;-4.44,-2.39,;-5.21,-1.05,;-6.75,-1.05,;-7.52,-2.39,;-6.75,-3.72,;-7.52,-5.05,;-5.21,-3.72,)| Show InChI InChI=1S/C24H26FN7O4S/c1-14-8-6-9-18(28-14)23-29-30-24(32(23)21-19(35-4)10-7-11-20(21)36-5)31-37(33,34)16(3)15(2)22-26-12-17(25)13-27-22/h6-13,15-16H,1-5H3,(H,30,31)/t15-,16-/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 | 0.600 | 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)) | BDBM269952
((2R)-2-(4-cyano-2-(methylsulfonyl)phenyl)-N-(4-(2,...)Show SMILES CO[C@H](CS(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ccc(cc1S(C)(=O)=O)C#N |r,wD:2.1,(4.77,-10.95,;3.43,-10.18,;3.43,-8.64,;2.1,-7.87,;.77,-8.64,;1.54,-9.97,;-0,-9.97,;-.57,-7.87,;-1.9,-8.64,;-2.38,-10.11,;-3.92,-10.11,;-4.39,-8.64,;-5.88,-8.24,;-6.28,-6.75,;-7.77,-6.36,;-8.86,-7.44,;-8.46,-8.93,;-9.55,-10.02,;-9.15,-11.51,;-6.97,-9.33,;-3.15,-7.74,;-3.15,-6.2,;-4.48,-5.43,;-5.81,-6.2,;-7.15,-5.43,;-4.48,-3.89,;-3.15,-3.12,;-1.81,-3.89,;-1.81,-5.43,;-.48,-6.2,;.85,-5.43,;4.77,-7.87,;6.1,-8.64,;7.44,-7.87,;7.44,-6.33,;6.1,-5.56,;4.77,-6.33,;3.43,-5.56,;2.1,-6.33,;2.66,-4.23,;4.2,-4.23,;8.77,-5.56,;10.1,-4.79,)| Show InChI InChI=1S/C27H28N6O8S2/c1-38-20-9-7-10-21(39-2)25(20)33-26(19-8-6-11-24(29-19)41-4)30-31-27(33)32-43(36,37)16-22(40-3)18-13-12-17(15-28)14-23(18)42(5,34)35/h6-14,22H,16H2,1-5H3,(H,31,32)/t22-/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 | 0.0730 | 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)) | BDBM269954
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cnc(C)cn2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.8,-10.19,;-9.2,-8.7,;-8.11,-7.61,;-8.5,-6.12,;-7.42,-5.04,;-5.93,-5.43,;-5.53,-6.92,;-6.62,-8.01,;-4.04,-7.32,;-3.57,-8.78,;-2.03,-8.78,;-1.55,-7.32,;-.22,-6.55,;1.12,-7.32,;1.89,-8.65,;.35,-8.65,;2.45,-6.55,;3.78,-7.32,;3.78,-8.86,;5.12,-6.55,;6.45,-7.32,;7.79,-6.55,;7.79,-5.01,;9.12,-4.24,;6.45,-4.24,;5.12,-5.01,;-2.8,-6.41,;-2.8,-4.87,;-4.13,-4.1,;-5.46,-4.87,;-6.8,-4.1,;-4.13,-2.56,;-2.8,-1.79,;-1.46,-2.56,;-1.46,-4.1,;-.13,-4.87,;1.2,-4.1,)| Show InChI InChI=1S/C23H25N7O6S/c1-14-11-25-16(12-24-14)17(31)13-37(32,33)29-23-28-27-22(15-7-5-10-20(26-15)36-4)30(23)21-18(34-2)8-6-9-19(21)35-3/h5-12,17,31H,13H2,1-4H3,(H,28,29)/t17-/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 | 1.20 | 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)) | BDBM269958
((2R)—N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)C[C@@H](O)c2cnc(C)nc2)n1-c1c(OC)cccc1OC |r,wD:17.18,(-8.8,-9.79,;-9.2,-8.3,;-8.11,-7.21,;-8.5,-5.73,;-7.42,-4.64,;-5.93,-5.04,;-5.53,-6.52,;-6.62,-7.61,;-4.04,-6.92,;-3.57,-8.39,;-2.03,-8.39,;-1.55,-6.92,;-.22,-6.15,;1.12,-6.92,;.35,-8.26,;1.89,-8.26,;2.45,-6.15,;3.78,-6.92,;3.78,-8.46,;5.12,-6.15,;6.45,-6.92,;7.79,-6.15,;7.79,-4.61,;9.12,-3.84,;6.45,-3.84,;5.12,-4.61,;-2.8,-6.02,;-2.8,-4.48,;-4.13,-3.71,;-5.46,-4.48,;-6.8,-3.71,;-4.13,-2.17,;-2.8,-1.4,;-1.46,-2.17,;-1.46,-3.71,;-.13,-4.48,;1.2,-3.71,)| Show InChI InChI=1S/C23H25N7O6S/c1-14-24-11-15(12-25-14)17(31)13-37(32,33)29-23-28-27-22(16-7-5-10-20(26-16)36-4)30(23)21-18(34-2)8-6-9-19(21)35-3/h5-12,17,31H,13H2,1-4H3,(H,28,29)/t17-/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 | 3.20 | 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)) | BDBM269961
((1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@@H](C)[C@@H](O)c2cnc(C)nc2)n1-c1c(OC)cccc1OC |r,wU:16.17,wD:18.19,(-8.8,-20.91,;-9.2,-19.43,;-8.11,-18.34,;-8.5,-16.85,;-7.42,-15.76,;-5.93,-16.16,;-5.53,-17.65,;-6.62,-18.74,;-4.04,-18.05,;-3.57,-19.51,;-2.03,-19.51,;-1.55,-18.05,;-.22,-17.28,;1.12,-18.05,;.35,-19.38,;1.89,-19.38,;2.45,-17.28,;2.45,-15.74,;3.78,-18.05,;3.78,-19.59,;5.12,-17.28,;6.45,-18.05,;7.79,-17.28,;7.79,-15.74,;9.12,-14.97,;6.45,-14.97,;5.12,-15.74,;-2.8,-17.14,;-2.8,-15.6,;-4.13,-14.83,;-5.46,-15.6,;-6.8,-14.83,;-4.13,-13.29,;-2.8,-12.52,;-1.46,-13.29,;-1.46,-14.83,;-.13,-15.6,;1.2,-14.83,)| Show InChI InChI=1S/C24H27N7O6S/c1-14(22(32)16-12-25-15(2)26-13-16)38(33,34)30-24-29-28-23(17-8-6-11-20(27-17)37-5)31(24)21-18(35-3)9-7-10-19(21)36-4/h6-14,22,32H,1-5H3,(H,29,30)/t14-,22+/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 | 7.20 | 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)) | BDBM269976
((1R,2S)—N-(4-(2,6-dimethoxyphenyl)-5-(6-metho...)Show SMILES CO[C@H]([C@@H](C)S(=O)(=O)Nc1nnc(-c2cccc(OC)n2)n1-c1c(OC)cccc1OC)c1ncc(C)nc1OC |r,wD:3.3,2.1,(5.64,-9.21,;4.31,-8.44,;4.31,-6.9,;2.98,-6.13,;2.98,-4.59,;1.64,-6.9,;.87,-8.24,;2.41,-8.24,;.31,-6.13,;-1.03,-6.9,;-1.5,-8.37,;-3.04,-8.37,;-3.52,-6.9,;-5,-6.51,;-5.4,-5.02,;-6.89,-4.62,;-7.98,-5.71,;-7.58,-7.2,;-8.67,-8.29,;-8.27,-9.77,;-6.09,-7.6,;-2.27,-6,;-2.27,-4.46,;-3.61,-3.69,;-4.94,-4.46,;-6.27,-3.69,;-3.61,-2.15,;-2.27,-1.38,;-.94,-2.15,;-.94,-3.69,;.4,-4.46,;1.73,-3.69,;5.64,-6.13,;5.64,-4.59,;6.98,-3.82,;8.31,-4.59,;9.64,-3.82,;8.31,-6.13,;6.98,-6.9,;6.98,-8.44,;8.31,-9.21,)| Show InChI InChI=1S/C26H31N7O7S/c1-15-14-27-21(25(28-15)40-7)23(39-6)16(2)41(34,35)32-26-31-30-24(17-10-8-13-20(29-17)38-5)33(26)22-18(36-3)11-9-12-19(22)37-4/h8-14,16,23H,1-7H3,(H,31,32)/t16-,23-/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 | 2.20 | 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 | |
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