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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Platelet glycoprotein 4' and Ligand = 'BDBM50394994'   
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
Platelet glycoprotein 4


(Rattus norvegicus)
BDBM50394994
PNG
(CHEMBL2163484 | US9708370, DBG-178p)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)NN(Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C43H54N12O7/c1-26(50-41(60)37(20-29-22-48-34-12-6-5-11-32(29)34)52-40(59)33(45)21-30-23-47-25-49-30)39(58)54-55(24-28-14-16-31(56)17-15-28)43(62)53-36(19-27-9-3-2-4-10-27)42(61)51-35(38(46)57)13-7-8-18-44/h2-6,9-12,14-17,22-23,25-26,33,35-37,48,56H,7-8,13,18-21,24,44-45H2,1H3,(H2,46,57)(H,47,49)(H,50,60)(H,51,61)(H,52,59)(H,53,62)(H,54,58)/t26-,33-,35-,36+,37+/m0/s1
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Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Inhibition of photoactivatable [125I]-Tyr-Bpa-Ala-hexarelin binding to CD36 in Sprague-Dawley rat heart membranes after 60 mins by SDS-PAGE analysis


J Med Chem 60: 9263-9274 (2017)


Article DOI: 10.1021/acs.jmedchem.7b01209
BindingDB Entry DOI: 10.7270/Q2GF0WWV
More data for this
Ligand-Target Pair
Platelet glycoprotein 4


(Rattus norvegicus)
BDBM50394994
PNG
(CHEMBL2163484 | US9708370, DBG-178p)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)NN(Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C43H54N12O7/c1-26(50-41(60)37(20-29-22-48-34-12-6-5-11-32(29)34)52-40(59)33(45)21-30-23-47-25-49-30)39(58)54-55(24-28-14-16-31(56)17-15-28)43(62)53-36(19-27-9-3-2-4-10-27)42(61)51-35(38(46)57)13-7-8-18-44/h2-6,9-12,14-17,22-23,25-26,33,35-37,48,56H,7-8,13,18-21,24,44-45H2,1H3,(H2,46,57)(H,47,49)(H,50,60)(H,51,61)(H,52,59)(H,53,62)(H,54,58)/t26-,33-,35-,36+,37+/m0/s1
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Article
PubMed
n/an/a 2.80E+4n/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of photoactivatable [125I]-Tyr-Bpa-Ala-Hexarelin from CD36 in Sprague-Dawley rat cardiac membranes incubated for 60 mins by densitometry


J Med Chem 55: 6502-11 (2012)


Article DOI: 10.1021/jm300557t
BindingDB Entry DOI: 10.7270/Q22J6D00
More data for this
Ligand-Target Pair
Platelet glycoprotein 4


(Rattus norvegicus)
BDBM50394994
PNG
(CHEMBL2163484 | US9708370, DBG-178p)
Show SMILES C[C@H](NC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)[C@@H](N)Cc1cnc[nH]1)C(=O)NN(Cc1ccc(O)cc1)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C43H54N12O7/c1-26(50-41(60)37(20-29-22-48-34-12-6-5-11-32(29)34)52-40(59)33(45)21-30-23-47-25-49-30)39(58)54-55(24-28-14-16-31(56)17-15-28)43(62)53-36(19-27-9-3-2-4-10-27)42(61)51-35(38(46)57)13-7-8-18-44/h2-6,9-12,14-17,22-23,25-26,33,35-37,48,56H,7-8,13,18-21,24,44-45H2,1H3,(H2,46,57)(H,47,49)(H,50,60)(H,51,61)(H,52,59)(H,53,62)(H,54,58)/t26-,33-,35-,36+,37+/m0/s1
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US Patent
n/an/a 2.80E+4n/an/an/an/a7.3n/a



VALORISATION-RECHERCHE, LIMITED PARTNERSHIP; VALORISATION HSJ, LIMITED PARTNERSHIP

US Patent


Assay Description
Competition experiments were performed by incubating 50 μg of LLC-PK1 membranes expressing human GHS-R1a with 15 fmol of 125I-Ghrelin and increa...


US Patent US9708370 (2017)


BindingDB Entry DOI: 10.7270/Q2XP76ZK
More data for this
Ligand-Target Pair