Found 34 hits Enz. Inhib. hit(s) with all data for entry = 50013865 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)) | BDBM50567169
(CHEMBL4873876)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(19.32,-34.97,;20.66,-35.74,;21.99,-34.96,;23.33,-35.72,;24.66,-34.94,;24.64,-33.41,;25.98,-32.63,;25.97,-31.09,;27.32,-33.39,;28.65,-32.62,;28.8,-31.09,;30.31,-30.76,;31.08,-32.09,;32.61,-32.25,;33.24,-33.66,;34.77,-33.81,;35.4,-35.21,;34.5,-36.46,;35.12,-37.87,;32.96,-36.3,;32.34,-34.9,;30.05,-33.24,;27.32,-34.93,;28.65,-35.71,;25.99,-35.7,;26,-37.24,;24.67,-38.01,;23.34,-37.25,;22.01,-38.02,;24.67,-39.55,;26,-40.32,;27.34,-39.55,;27.33,-38,;28.67,-37.23,;30,-38,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet 
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| 0.0740 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Displacement of [3H]Apelin-13 from human APJ receptor stably expressed in human HEK293 cell membrane incubated for 120 mins by TopCount scintillation... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50014619
(CHEMBL3184840)Show SMILES CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C69H108N22O16S/c1-39(2)32-47(85-57(96)43(17-9-26-76-68(71)72)82-63(102)52-20-12-29-90(52)65(104)45(18-10-27-77-69(73)74)83-58(97)44-22-23-54(93)80-44)59(98)88-50(37-92)61(100)86-48(34-41-35-75-38-79-41)60(99)81-42(16-7-8-25-70)56(95)78-36-55(94)89-28-11-19-51(89)62(101)84-46(24-31-108-3)66(105)91-30-13-21-53(91)64(103)87-49(67(106)107)33-40-14-5-4-6-15-40/h4-6,14-15,35,38-39,42-53,92H,7-13,16-34,36-37,70H2,1-3H3,(H,75,79)(H,78,95)(H,80,93)(H,81,99)(H,82,102)(H,83,97)(H,84,101)(H,85,96)(H,86,100)(H,87,103)(H,88,98)(H,106,107)(H4,71,72,76)(H4,73,74,77)/t42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 0.170 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Displacement of [3H]Apelin-13 from human APJ receptor stably expressed in human HEK293 cell membrane incubated for 120 mins by TopCount scintillation... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570416
(CHEMBL4871403)Show SMILES CCCCc1[nH]c(=O)c(-c2nc(Cc3ccccc3)no2)c(O)c1-c1c(OC)cccc1OC |(30.75,-4.85,;32.08,-5.61,;33.41,-4.84,;34.75,-5.6,;36.08,-4.82,;36.07,-3.28,;37.41,-2.5,;37.4,-.96,;38.74,-3.27,;40.07,-2.5,;41.48,-3.12,;42.51,-1.97,;44.04,-2.13,;44.67,-3.53,;43.76,-4.78,;44.39,-6.18,;45.92,-6.34,;46.83,-5.08,;46.19,-3.68,;41.73,-.64,;40.23,-.96,;38.75,-4.81,;40.08,-5.58,;37.41,-5.58,;37.42,-7.12,;36.09,-7.89,;34.76,-7.12,;33.43,-7.9,;36.09,-9.43,;37.43,-10.2,;38.76,-9.43,;38.76,-7.88,;40.09,-7.11,;41.43,-7.88,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 43 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570417
(CHEMBL4858384)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(48.64,-5.04,;49.98,-5.8,;51.31,-5.02,;52.65,-5.79,;53.98,-5.01,;53.97,-3.47,;55.3,-2.69,;55.3,-1.15,;56.64,-3.46,;57.97,-2.68,;58.13,-1.15,;59.63,-.83,;60.41,-2.16,;61.94,-2.31,;62.57,-3.72,;61.66,-4.96,;62.29,-6.37,;63.82,-6.53,;64.73,-5.27,;64.09,-3.87,;59.38,-3.3,;56.65,-5,;57.98,-5.77,;55.31,-5.77,;55.32,-7.3,;53.99,-8.07,;52.66,-7.31,;51.33,-8.08,;53.99,-9.62,;55.32,-10.39,;56.66,-9.62,;56.66,-8.07,;57.99,-7.3,;59.32,-8.06,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 13 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570418
(CHEMBL4857233)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(.71,-14.58,;2.05,-15.34,;3.38,-14.57,;4.71,-15.33,;6.04,-14.55,;6.03,-13.01,;7.37,-12.23,;7.36,-10.69,;8.71,-13,;10.04,-12.23,;10.19,-10.69,;11.7,-10.37,;12.47,-11.7,;14,-11.86,;14.63,-13.26,;13.72,-14.51,;14.35,-15.91,;15.89,-16.07,;16.79,-14.81,;16.16,-13.41,;17.06,-12.16,;11.44,-12.85,;8.71,-14.54,;10.04,-15.31,;7.38,-15.31,;7.38,-16.85,;6.06,-17.62,;4.73,-16.85,;3.39,-17.63,;6.05,-19.16,;7.39,-19.93,;8.73,-19.16,;8.72,-17.61,;10.05,-16.84,;11.39,-17.61,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 8.60 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570419
(CHEMBL4861906)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(17.91,-14.72,;19.24,-15.48,;20.57,-14.71,;21.91,-15.47,;23.24,-14.69,;23.23,-13.15,;24.57,-12.37,;24.56,-10.83,;25.9,-13.14,;27.23,-12.37,;27.39,-10.83,;28.89,-10.51,;29.67,-11.84,;31.2,-12,;31.83,-13.4,;30.92,-14.65,;31.55,-16.05,;33.08,-16.21,;33.99,-14.95,;35.52,-15.11,;33.35,-13.55,;28.64,-12.99,;25.91,-14.68,;27.24,-15.45,;24.57,-15.45,;24.58,-16.99,;23.25,-17.76,;21.92,-16.99,;20.59,-17.77,;23.25,-19.3,;24.58,-20.07,;25.92,-19.3,;25.92,-17.75,;27.25,-16.98,;28.58,-17.75,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.60 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570420
(CHEMBL4861053)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(36.73,-14.63,;38.06,-15.39,;39.39,-14.61,;40.73,-15.37,;42.06,-14.6,;42.05,-13.06,;43.39,-12.28,;43.38,-10.74,;44.72,-13.05,;46.05,-12.27,;46.21,-10.74,;47.71,-10.42,;48.49,-11.75,;50.02,-11.9,;50.65,-13.31,;49.74,-14.55,;50.37,-15.96,;51.9,-16.12,;52.53,-17.53,;52.81,-14.86,;52.17,-13.46,;47.46,-12.89,;44.73,-14.58,;46.06,-15.36,;43.39,-15.36,;43.4,-16.89,;42.07,-17.66,;40.74,-16.9,;39.41,-17.67,;42.07,-19.21,;43.41,-19.98,;44.74,-19.21,;44.74,-17.66,;46.07,-16.88,;47.4,-17.65,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.400 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570421
(CHEMBL4878068)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(o2)-c2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(53.34,-14.22,;54.68,-14.98,;56.01,-14.2,;57.35,-14.96,;58.68,-14.19,;58.67,-12.65,;60,-11.87,;60,-10.33,;61.34,-12.63,;62.67,-11.86,;62.82,-10.33,;64.33,-10,;65.1,-11.34,;64.08,-12.48,;66.64,-11.49,;67.26,-12.9,;68.79,-13.06,;69.69,-11.81,;71.22,-11.97,;69.05,-10.4,;67.53,-10.25,;61.34,-14.17,;62.67,-14.95,;60.01,-14.95,;60.02,-16.48,;58.69,-17.25,;57.36,-16.49,;56.03,-17.26,;58.69,-18.8,;60.02,-19.57,;61.36,-18.8,;61.35,-17.24,;62.69,-16.47,;64.02,-17.24,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 180 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570422
(CHEMBL4852391)Show SMILES COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CC1 |(.41,-28.21,;1.74,-27.44,;3.07,-28.2,;3.07,-29.75,;4.4,-30.52,;5.74,-29.75,;5.73,-28.19,;7.07,-27.42,;8.4,-28.19,;4.4,-27.43,;4.39,-25.9,;5.72,-25.12,;7.05,-25.9,;5.72,-23.59,;7.05,-22.81,;7.2,-21.28,;8.71,-20.95,;9.48,-22.29,;11.01,-22.44,;11.64,-23.85,;10.74,-25.09,;11.37,-26.5,;12.9,-26.65,;13.52,-28.06,;13.8,-25.4,;13.17,-24,;8.45,-23.43,;4.38,-22.82,;4.38,-21.28,;3.05,-23.6,;3.06,-25.14,;1.73,-25.91,;.18,-25.93,;.96,-27.26,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 11 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570423
(CHEMBL4846150)Show SMILES COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CCCC1 |(16.9,-27.97,;18.24,-27.2,;19.57,-27.96,;19.56,-29.5,;20.9,-30.28,;22.24,-29.5,;22.23,-27.95,;23.56,-27.18,;24.9,-27.95,;20.89,-27.19,;20.88,-25.66,;22.22,-24.88,;23.55,-25.66,;22.22,-23.34,;23.55,-22.57,;23.7,-21.04,;25.21,-20.71,;25.98,-22.04,;27.51,-22.2,;28.14,-23.61,;27.23,-24.85,;27.86,-26.26,;29.4,-26.41,;30.02,-27.82,;30.3,-25.16,;29.66,-23.76,;24.95,-23.19,;20.88,-22.58,;20.87,-21.04,;19.54,-23.36,;19.55,-24.89,;18.12,-25.44,;16.82,-24.61,;15.62,-25.57,;16.17,-27.01,;17.71,-26.94,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.240 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570424
(CHEMBL4860991)Show SMILES COCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(32.64,-24.82,;33.98,-25.59,;35.31,-24.81,;36.65,-25.57,;37.98,-24.79,;37.97,-23.26,;39.3,-22.48,;39.3,-20.94,;40.64,-23.24,;41.97,-22.47,;42.12,-20.94,;43.63,-20.61,;44.4,-21.94,;45.94,-22.1,;46.56,-23.51,;45.66,-24.75,;46.29,-26.15,;47.82,-26.31,;48.45,-27.72,;48.72,-25.05,;48.09,-23.66,;43.38,-23.09,;40.64,-24.78,;41.97,-25.55,;39.31,-25.55,;39.32,-27.09,;37.99,-27.86,;36.66,-27.09,;35.33,-27.87,;37.99,-29.4,;39.32,-30.17,;40.66,-29.4,;40.65,-27.85,;41.99,-27.08,;43.32,-27.85,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.940 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570425
(CHEMBL4866313)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(51.08,-24.65,;52.42,-25.41,;53.75,-24.63,;55.09,-25.39,;56.42,-24.61,;56.41,-23.08,;57.74,-22.3,;57.74,-20.76,;59.08,-23.06,;60.41,-22.29,;60.57,-20.76,;62.07,-20.43,;62.84,-21.76,;64.38,-21.92,;65.01,-23.33,;64.1,-24.57,;64.73,-25.98,;66.26,-26.13,;66.89,-27.54,;67.16,-24.88,;66.53,-23.48,;61.82,-22.91,;59.09,-24.6,;60.42,-25.38,;57.75,-25.38,;57.76,-26.91,;56.43,-27.68,;55.1,-26.92,;53.77,-27.69,;56.43,-29.22,;57.76,-30,;59.1,-29.22,;59.1,-27.67,;60.43,-26.9,;61.76,-27.67,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.120 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570426
(CHEMBL4876050)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(.83,-34.32,;2.17,-35.08,;3.5,-34.31,;4.84,-35.07,;6.17,-34.29,;6.16,-32.75,;7.49,-31.97,;7.49,-30.43,;8.83,-32.74,;10.16,-31.97,;10.31,-30.43,;11.82,-30.11,;12.59,-31.44,;14.13,-31.6,;14.76,-33,;16.28,-33.15,;16.91,-34.55,;16.01,-35.81,;16.64,-37.22,;14.48,-35.65,;13.85,-34.25,;11.57,-32.59,;8.83,-34.28,;10.16,-35.05,;7.5,-35.05,;7.51,-36.59,;6.18,-37.36,;4.85,-36.59,;3.52,-37.36,;6.18,-38.9,;7.51,-39.67,;8.85,-38.9,;8.84,-37.35,;10.18,-36.58,;11.51,-37.35,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.170 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50567169
(CHEMBL4873876)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(19.32,-34.97,;20.66,-35.74,;21.99,-34.96,;23.33,-35.72,;24.66,-34.94,;24.64,-33.41,;25.98,-32.63,;25.97,-31.09,;27.32,-33.39,;28.65,-32.62,;28.8,-31.09,;30.31,-30.76,;31.08,-32.09,;32.61,-32.25,;33.24,-33.66,;34.77,-33.81,;35.4,-35.21,;34.5,-36.46,;35.12,-37.87,;32.96,-36.3,;32.34,-34.9,;30.05,-33.24,;27.32,-34.93,;28.65,-35.71,;25.99,-35.7,;26,-37.24,;24.67,-38.01,;23.34,-37.25,;22.01,-38.02,;24.67,-39.55,;26,-40.32,;27.34,-39.55,;27.33,-38,;28.67,-37.23,;30,-38,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
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UniChem
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| n/a | n/a | n/a | n/a | 0.0230 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50014619
(CHEMBL3184840)Show SMILES CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C69H108N22O16S/c1-39(2)32-47(85-57(96)43(17-9-26-76-68(71)72)82-63(102)52-20-12-29-90(52)65(104)45(18-10-27-77-69(73)74)83-58(97)44-22-23-54(93)80-44)59(98)88-50(37-92)61(100)86-48(34-41-35-75-38-79-41)60(99)81-42(16-7-8-25-70)56(95)78-36-55(94)89-28-11-19-51(89)62(101)84-46(24-31-108-3)66(105)91-30-13-21-53(91)64(103)87-49(67(106)107)33-40-14-5-4-6-15-40/h4-6,14-15,35,38-39,42-53,92H,7-13,16-34,36-37,70H2,1-3H3,(H,75,79)(H,78,95)(H,80,93)(H,81,99)(H,82,102)(H,83,97)(H,84,101)(H,85,96)(H,86,100)(H,87,103)(H,88,98)(H,106,107)(H4,71,72,76)(H4,73,74,77)/t42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
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CHEMBL
MCE
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Similars
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| n/a | n/a | n/a | n/a | 0.0500 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570414
(CHEMBL4861181)Show SMILES CCCCc1[nH]c(=O)c(C(=O)OCC)c(O)c1-c1c(OC)cccc1OC |(.82,-4.56,;2.16,-5.33,;3.49,-4.55,;4.82,-5.31,;6.15,-4.53,;6.14,-3,;7.48,-2.21,;7.47,-.67,;8.81,-2.98,;10.15,-2.21,;10.14,-.67,;11.48,-2.98,;12.81,-2.2,;14.15,-2.97,;8.82,-4.52,;10.15,-5.29,;7.48,-5.29,;7.49,-6.83,;6.17,-7.6,;4.83,-6.83,;3.5,-7.61,;6.16,-9.14,;7.5,-9.91,;8.83,-9.14,;8.83,-7.59,;10.16,-6.82,;11.5,-7.59,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 980 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570415
(CHEMBL4873340)Show SMILES CCCCc1[nH]c(=O)c(-c2n[nH]c(Cc3ccccc3)n2)c(O)c1-c1c(OC)cccc1OC |(13.71,-4.63,;15.04,-5.39,;16.37,-4.61,;17.71,-5.37,;19.04,-4.6,;19.03,-3.06,;20.37,-2.28,;20.36,-.74,;21.7,-3.04,;23.03,-2.27,;23.19,-.74,;24.69,-.41,;25.47,-1.75,;27,-1.9,;27.63,-3.31,;26.72,-4.55,;27.35,-5.96,;28.88,-6.11,;29.79,-4.86,;29.15,-3.46,;24.44,-2.89,;21.71,-4.58,;23.04,-5.36,;20.37,-5.36,;20.38,-6.89,;19.05,-7.66,;17.72,-6.9,;16.39,-7.67,;19.05,-9.21,;20.39,-9.98,;21.72,-9.2,;21.72,-7.65,;23.05,-6.88,;24.38,-7.65,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 430 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570416
(CHEMBL4871403)Show SMILES CCCCc1[nH]c(=O)c(-c2nc(Cc3ccccc3)no2)c(O)c1-c1c(OC)cccc1OC |(30.75,-4.85,;32.08,-5.61,;33.41,-4.84,;34.75,-5.6,;36.08,-4.82,;36.07,-3.28,;37.41,-2.5,;37.4,-.96,;38.74,-3.27,;40.07,-2.5,;41.48,-3.12,;42.51,-1.97,;44.04,-2.13,;44.67,-3.53,;43.76,-4.78,;44.39,-6.18,;45.92,-6.34,;46.83,-5.08,;46.19,-3.68,;41.73,-.64,;40.23,-.96,;38.75,-4.81,;40.08,-5.58,;37.41,-5.58,;37.42,-7.12,;36.09,-7.89,;34.76,-7.12,;33.43,-7.9,;36.09,-9.43,;37.43,-10.2,;38.76,-9.43,;38.76,-7.88,;40.09,-7.11,;41.43,-7.88,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 120 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570417
(CHEMBL4858384)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3)o2)c(O)c1-c1c(OC)cccc1OC |(48.64,-5.04,;49.98,-5.8,;51.31,-5.02,;52.65,-5.79,;53.98,-5.01,;53.97,-3.47,;55.3,-2.69,;55.3,-1.15,;56.64,-3.46,;57.97,-2.68,;58.13,-1.15,;59.63,-.83,;60.41,-2.16,;61.94,-2.31,;62.57,-3.72,;61.66,-4.96,;62.29,-6.37,;63.82,-6.53,;64.73,-5.27,;64.09,-3.87,;59.38,-3.3,;56.65,-5,;57.98,-5.77,;55.31,-5.77,;55.32,-7.3,;53.99,-8.07,;52.66,-7.31,;51.33,-8.08,;53.99,-9.62,;55.32,-10.39,;56.66,-9.62,;56.66,-8.07,;57.99,-7.3,;59.32,-8.06,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 31 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570418
(CHEMBL4857233)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccccc3Cl)o2)c(O)c1-c1c(OC)cccc1OC |(.71,-14.58,;2.05,-15.34,;3.38,-14.57,;4.71,-15.33,;6.04,-14.55,;6.03,-13.01,;7.37,-12.23,;7.36,-10.69,;8.71,-13,;10.04,-12.23,;10.19,-10.69,;11.7,-10.37,;12.47,-11.7,;14,-11.86,;14.63,-13.26,;13.72,-14.51,;14.35,-15.91,;15.89,-16.07,;16.79,-14.81,;16.16,-13.41,;17.06,-12.16,;11.44,-12.85,;8.71,-14.54,;10.04,-15.31,;7.38,-15.31,;7.38,-16.85,;6.06,-17.62,;4.73,-16.85,;3.39,-17.63,;6.05,-19.16,;7.39,-19.93,;8.73,-19.16,;8.72,-17.61,;10.05,-16.84,;11.39,-17.61,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 18 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570419
(CHEMBL4861906)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3cccc(Cl)c3)o2)c(O)c1-c1c(OC)cccc1OC |(17.91,-14.72,;19.24,-15.48,;20.57,-14.71,;21.91,-15.47,;23.24,-14.69,;23.23,-13.15,;24.57,-12.37,;24.56,-10.83,;25.9,-13.14,;27.23,-12.37,;27.39,-10.83,;28.89,-10.51,;29.67,-11.84,;31.2,-12,;31.83,-13.4,;30.92,-14.65,;31.55,-16.05,;33.08,-16.21,;33.99,-14.95,;35.52,-15.11,;33.35,-13.55,;28.64,-12.99,;25.91,-14.68,;27.24,-15.45,;24.57,-15.45,;24.58,-16.99,;23.25,-17.76,;21.92,-16.99,;20.59,-17.77,;23.25,-19.3,;24.58,-20.07,;25.92,-19.3,;25.92,-17.75,;27.25,-16.98,;28.58,-17.75,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.30 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570420
(CHEMBL4861053)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(36.73,-14.63,;38.06,-15.39,;39.39,-14.61,;40.73,-15.37,;42.06,-14.6,;42.05,-13.06,;43.39,-12.28,;43.38,-10.74,;44.72,-13.05,;46.05,-12.27,;46.21,-10.74,;47.71,-10.42,;48.49,-11.75,;50.02,-11.9,;50.65,-13.31,;49.74,-14.55,;50.37,-15.96,;51.9,-16.12,;52.53,-17.53,;52.81,-14.86,;52.17,-13.46,;47.46,-12.89,;44.73,-14.58,;46.06,-15.36,;43.39,-15.36,;43.4,-16.89,;42.07,-17.66,;40.74,-16.9,;39.41,-17.67,;42.07,-19.21,;43.41,-19.98,;44.74,-19.21,;44.74,-17.66,;46.07,-16.88,;47.4,-17.65,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.20 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570421
(CHEMBL4878068)Show SMILES CCCCc1[nH]c(=O)c(-c2nnc(o2)-c2ccc(Cl)cc2)c(O)c1-c1c(OC)cccc1OC |(53.34,-14.22,;54.68,-14.98,;56.01,-14.2,;57.35,-14.96,;58.68,-14.19,;58.67,-12.65,;60,-11.87,;60,-10.33,;61.34,-12.63,;62.67,-11.86,;62.82,-10.33,;64.33,-10,;65.1,-11.34,;64.08,-12.48,;66.64,-11.49,;67.26,-12.9,;68.79,-13.06,;69.69,-11.81,;71.22,-11.97,;69.05,-10.4,;67.53,-10.25,;61.34,-14.17,;62.67,-14.95,;60.01,-14.95,;60.02,-16.48,;58.69,-17.25,;57.36,-16.49,;56.03,-17.26,;58.69,-18.8,;60.02,-19.57,;61.36,-18.8,;61.35,-17.24,;62.69,-16.47,;64.02,-17.24,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 450 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570422
(CHEMBL4852391)Show SMILES COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CC1 |(.41,-28.21,;1.74,-27.44,;3.07,-28.2,;3.07,-29.75,;4.4,-30.52,;5.74,-29.75,;5.73,-28.19,;7.07,-27.42,;8.4,-28.19,;4.4,-27.43,;4.39,-25.9,;5.72,-25.12,;7.05,-25.9,;5.72,-23.59,;7.05,-22.81,;7.2,-21.28,;8.71,-20.95,;9.48,-22.29,;11.01,-22.44,;11.64,-23.85,;10.74,-25.09,;11.37,-26.5,;12.9,-26.65,;13.52,-28.06,;13.8,-25.4,;13.17,-24,;8.45,-23.43,;4.38,-22.82,;4.38,-21.28,;3.05,-23.6,;3.06,-25.14,;1.73,-25.91,;.18,-25.93,;.96,-27.26,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 15 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570423
(CHEMBL4846150)Show SMILES COc1cccc(OC)c1-c1c(O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(=O)[nH]c1C1CCCC1 |(16.9,-27.97,;18.24,-27.2,;19.57,-27.96,;19.56,-29.5,;20.9,-30.28,;22.24,-29.5,;22.23,-27.95,;23.56,-27.18,;24.9,-27.95,;20.89,-27.19,;20.88,-25.66,;22.22,-24.88,;23.55,-25.66,;22.22,-23.34,;23.55,-22.57,;23.7,-21.04,;25.21,-20.71,;25.98,-22.04,;27.51,-22.2,;28.14,-23.61,;27.23,-24.85,;27.86,-26.26,;29.4,-26.41,;30.02,-27.82,;30.3,-25.16,;29.66,-23.76,;24.95,-23.19,;20.88,-22.58,;20.87,-21.04,;19.54,-23.36,;19.55,-24.89,;18.12,-25.44,;16.82,-24.61,;15.62,-25.57,;16.17,-27.01,;17.71,-26.94,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.510 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570424
(CHEMBL4860991)Show SMILES COCCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(32.64,-24.82,;33.98,-25.59,;35.31,-24.81,;36.65,-25.57,;37.98,-24.79,;37.97,-23.26,;39.3,-22.48,;39.3,-20.94,;40.64,-23.24,;41.97,-22.47,;42.12,-20.94,;43.63,-20.61,;44.4,-21.94,;45.94,-22.1,;46.56,-23.51,;45.66,-24.75,;46.29,-26.15,;47.82,-26.31,;48.45,-27.72,;48.72,-25.05,;48.09,-23.66,;43.38,-23.09,;40.64,-24.78,;41.97,-25.55,;39.31,-25.55,;39.32,-27.09,;37.99,-27.86,;36.66,-27.09,;35.33,-27.87,;37.99,-29.4,;39.32,-30.17,;40.66,-29.4,;40.65,-27.85,;41.99,-27.08,;43.32,-27.85,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.40 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570425
(CHEMBL4866313)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cc3)o2)c(O)c1-c1c(OC)cccc1OC |(51.08,-24.65,;52.42,-25.41,;53.75,-24.63,;55.09,-25.39,;56.42,-24.61,;56.41,-23.08,;57.74,-22.3,;57.74,-20.76,;59.08,-23.06,;60.41,-22.29,;60.57,-20.76,;62.07,-20.43,;62.84,-21.76,;64.38,-21.92,;65.01,-23.33,;64.1,-24.57,;64.73,-25.98,;66.26,-26.13,;66.89,-27.54,;67.16,-24.88,;66.53,-23.48,;61.82,-22.91,;59.09,-24.6,;60.42,-25.38,;57.75,-25.38,;57.76,-26.91,;56.43,-27.68,;55.1,-26.92,;53.77,-27.69,;56.43,-29.22,;57.76,-30,;59.1,-29.22,;59.1,-27.67,;60.43,-26.9,;61.76,-27.67,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.230 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50570426
(CHEMBL4876050)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)nc3)o2)c(O)c1-c1c(OC)cccc1OC |(.83,-34.32,;2.17,-35.08,;3.5,-34.31,;4.84,-35.07,;6.17,-34.29,;6.16,-32.75,;7.49,-31.97,;7.49,-30.43,;8.83,-32.74,;10.16,-31.97,;10.31,-30.43,;11.82,-30.11,;12.59,-31.44,;14.13,-31.6,;14.76,-33,;16.28,-33.15,;16.91,-34.55,;16.01,-35.81,;16.64,-37.22,;14.48,-35.65,;13.85,-34.25,;11.57,-32.59,;8.83,-34.28,;10.16,-35.05,;7.5,-35.05,;7.51,-36.59,;6.18,-37.36,;4.85,-36.59,;3.52,-37.36,;6.18,-38.9,;7.51,-39.67,;8.85,-38.9,;8.84,-37.35,;10.18,-36.58,;11.51,-37.35,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.580 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50567169
(CHEMBL4873876)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(19.32,-34.97,;20.66,-35.74,;21.99,-34.96,;23.33,-35.72,;24.66,-34.94,;24.64,-33.41,;25.98,-32.63,;25.97,-31.09,;27.32,-33.39,;28.65,-32.62,;28.8,-31.09,;30.31,-30.76,;31.08,-32.09,;32.61,-32.25,;33.24,-33.66,;34.77,-33.81,;35.4,-35.21,;34.5,-36.46,;35.12,-37.87,;32.96,-36.3,;32.34,-34.9,;30.05,-33.24,;27.32,-34.93,;28.65,-35.71,;25.99,-35.7,;26,-37.24,;24.67,-38.01,;23.34,-37.25,;22.01,-38.02,;24.67,-39.55,;26,-40.32,;27.34,-39.55,;27.33,-38,;28.67,-37.23,;30,-38,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 0.0240 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Rattus norvegicus) | BDBM50014619
(CHEMBL3184840)Show SMILES CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C69H108N22O16S/c1-39(2)32-47(85-57(96)43(17-9-26-76-68(71)72)82-63(102)52-20-12-29-90(52)65(104)45(18-10-27-77-69(73)74)83-58(97)44-22-23-54(93)80-44)59(98)88-50(37-92)61(100)86-48(34-41-35-75-38-79-41)60(99)81-42(16-7-8-25-70)56(95)78-36-55(94)89-28-11-19-51(89)62(101)84-46(24-31-108-3)66(105)91-30-13-21-53(91)64(103)87-49(67(106)107)33-40-14-5-4-6-15-40/h4-6,14-15,35,38-39,42-53,92H,7-13,16-34,36-37,70H2,1-3H3,(H,75,79)(H,78,95)(H,80,93)(H,81,99)(H,82,102)(H,83,97)(H,84,101)(H,85,96)(H,86,100)(H,87,103)(H,88,98)(H,106,107)(H4,71,72,76)(H4,73,74,77)/t42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-/m0/s1 | PDB
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CHEMBL
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Similars
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PubMed
| n/a | n/a | n/a | n/a | 0.0600 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at rat APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 hr... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50567169
(CHEMBL4873876)Show SMILES CCOCc1[nH]c(=O)c(-c2nnc(Cc3ccc(Cl)cn3)o2)c(O)c1-c1c(OC)cccc1OC |(19.32,-34.97,;20.66,-35.74,;21.99,-34.96,;23.33,-35.72,;24.66,-34.94,;24.64,-33.41,;25.98,-32.63,;25.97,-31.09,;27.32,-33.39,;28.65,-32.62,;28.8,-31.09,;30.31,-30.76,;31.08,-32.09,;32.61,-32.25,;33.24,-33.66,;34.77,-33.81,;35.4,-35.21,;34.5,-36.46,;35.12,-37.87,;32.96,-36.3,;32.34,-34.9,;30.05,-33.24,;27.32,-34.93,;28.65,-35.71,;25.99,-35.7,;26,-37.24,;24.67,-38.01,;23.34,-37.25,;22.01,-38.02,;24.67,-39.55,;26,-40.32,;27.34,-39.55,;27.33,-38,;28.67,-37.23,;30,-38,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.10 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor stably expressed in CHO-K1 cells assessed as induction of beta-arrestin 2 recruitment incubated for 90 mins by... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50014619
(CHEMBL3184840)Show SMILES CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCC(=O)N1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(O)=O Show InChI InChI=1S/C69H108N22O16S/c1-39(2)32-47(85-57(96)43(17-9-26-76-68(71)72)82-63(102)52-20-12-29-90(52)65(104)45(18-10-27-77-69(73)74)83-58(97)44-22-23-54(93)80-44)59(98)88-50(37-92)61(100)86-48(34-41-35-75-38-79-41)60(99)81-42(16-7-8-25-70)56(95)78-36-55(94)89-28-11-19-51(89)62(101)84-46(24-31-108-3)66(105)91-30-13-21-53(91)64(103)87-49(67(106)107)33-40-14-5-4-6-15-40/h4-6,14-15,35,38-39,42-53,92H,7-13,16-34,36-37,70H2,1-3H3,(H,75,79)(H,78,95)(H,80,93)(H,81,99)(H,82,102)(H,83,97)(H,84,101)(H,85,96)(H,86,100)(H,87,103)(H,88,98)(H,106,107)(H4,71,72,76)(H4,73,74,77)/t42-,43-,44-,45-,46-,47-,48-,49-,50-,51-,52-,53-/m0/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | n/a | n/a | 18 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor stably expressed in CHO-K1 cells assessed as induction of beta-arrestin 2 recruitment incubated for 90 mins by... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570414
(CHEMBL4861181)Show SMILES CCCCc1[nH]c(=O)c(C(=O)OCC)c(O)c1-c1c(OC)cccc1OC |(.82,-4.56,;2.16,-5.33,;3.49,-4.55,;4.82,-5.31,;6.15,-4.53,;6.14,-3,;7.48,-2.21,;7.47,-.67,;8.81,-2.98,;10.15,-2.21,;10.14,-.67,;11.48,-2.98,;12.81,-2.2,;14.15,-2.97,;8.82,-4.52,;10.15,-5.29,;7.48,-5.29,;7.49,-6.83,;6.17,-7.6,;4.83,-6.83,;3.5,-7.61,;6.16,-9.14,;7.5,-9.91,;8.83,-9.14,;8.83,-7.59,;10.16,-6.82,;11.5,-7.59,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 450 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
Apelin receptor
(Homo sapiens (Human)) | BDBM50570415
(CHEMBL4873340)Show SMILES CCCCc1[nH]c(=O)c(-c2n[nH]c(Cc3ccccc3)n2)c(O)c1-c1c(OC)cccc1OC |(13.71,-4.63,;15.04,-5.39,;16.37,-4.61,;17.71,-5.37,;19.04,-4.6,;19.03,-3.06,;20.37,-2.28,;20.36,-.74,;21.7,-3.04,;23.03,-2.27,;23.19,-.74,;24.69,-.41,;25.47,-1.75,;27,-1.9,;27.63,-3.31,;26.72,-4.55,;27.35,-5.96,;28.88,-6.11,;29.79,-4.86,;29.15,-3.46,;24.44,-2.89,;21.71,-4.58,;23.04,-5.36,;20.37,-5.36,;20.38,-6.89,;19.05,-7.66,;17.72,-6.9,;16.39,-7.67,;19.05,-9.21,;20.39,-9.98,;21.72,-9.2,;21.72,-7.65,;23.05,-6.88,;24.38,-7.65,)| | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 330 | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Agonist activity at human APJ receptor expressed in human HEK293 cells assessed as inhibition of forskolin-induced cAMP accumulation incubated for 1 ... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01878
BindingDB Entry DOI: 10.7270/Q20G3PXZ |
More data for this
Ligand-Target Pair | |
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