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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Apelin receptor' and Ligand = 'BDBM50577739'   
Target/Host
(Institution)
LigandTarget/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
pHTemp
°C
Apelin receptor


(Rattus norvegicus)
BDBM50577739
PNG
(CHEMBL4863722)
Show SMILES CCCCc1[nH]c(=O)c(C(=O)NCC)c(O)c1-c1c(OC)cccc1OC |(32.08,-11.24,;33.41,-12,;34.74,-11.23,;36.08,-12,;37.41,-11.23,;37.41,-9.68,;38.75,-8.91,;38.75,-7.37,;40.08,-9.68,;41.41,-8.91,;41.42,-7.37,;42.75,-9.69,;44.08,-8.92,;45.41,-9.69,;40.08,-11.22,;41.41,-11.99,;38.75,-11.99,;38.75,-13.52,;40.09,-14.28,;41.42,-13.51,;42.76,-14.27,;40.09,-15.83,;38.76,-16.6,;37.42,-15.83,;37.42,-14.29,;36.09,-13.52,;34.76,-14.29,)|
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at rat APJ receptor expressed in HEK293T cells assessed as compound stimulated inhibition of forskolin stimulated cAMP production in...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00385
BindingDB Entry DOI: 10.7270/Q2M330MF
More data for this
Ligand-Target Pair
Apelin receptor


(Homo sapiens (Human))
BDBM50577739
PNG
(CHEMBL4863722)
Show SMILES CCCCc1[nH]c(=O)c(C(=O)NCC)c(O)c1-c1c(OC)cccc1OC |(32.08,-11.24,;33.41,-12,;34.74,-11.23,;36.08,-12,;37.41,-11.23,;37.41,-9.68,;38.75,-8.91,;38.75,-7.37,;40.08,-9.68,;41.41,-8.91,;41.42,-7.37,;42.75,-9.69,;44.08,-8.92,;45.41,-9.69,;40.08,-11.22,;41.41,-11.99,;38.75,-11.99,;38.75,-13.52,;40.09,-14.28,;41.42,-13.51,;42.76,-14.27,;40.09,-15.83,;38.76,-16.6,;37.42,-15.83,;37.42,-14.29,;36.09,-13.52,;34.76,-14.29,)|
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at human APJ receptor expressed in HEK293T cells assessed as compound stimulated inhibition of forskolin stimulated cAMP production ...


Citation and Details

Article DOI: 10.1021/acsmedchemlett.1c00385
BindingDB Entry DOI: 10.7270/Q2M330MF
More data for this
Ligand-Target Pair