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BDBM50395024 CHEMBL2163444::US9708370, CP-2A(v)

SMILES: C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O

InChI Key: InChIKey=VLVLTJYWRZVAJZ-PDKHXXOHSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50395024   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))
BDBM50395024
PNG
(CHEMBL2163444 | US9708370, CP-2A(v))
Show SMILES C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C41H51N11O6/c1-24(43)37(54)48-35(21-27-23-46-31-16-8-6-14-29(27)31)40(57)51-52-41(58)50-34(20-26-22-45-30-15-7-5-13-28(26)30)39(56)49-33(19-25-11-3-2-4-12-25)38(55)47-32(36(44)53)17-9-10-18-42/h2-8,11-16,22-24,32-35,45-46H,9-10,17-21,42-43H2,1H3,(H2,44,53)(H,47,55)(H,48,54)(H,49,56)(H,51,57)(H2,50,52,58)/t24-,32-,33+,34-,35+/m0/s1
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antibodypedia
GoogleScholar
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CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 568n/an/an/an/an/an/a



Universit£ de Montr£al

Curated by ChEMBL


Assay Description
Displacement of [125I]ghrelin expressed in in LLC-PK1 cells incubated for 1 hr by gamma counting method


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)
BDBM50395024
PNG
(CHEMBL2163444 | US9708370, CP-2A(v))
Show SMILES C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C41H51N11O6/c1-24(43)37(54)48-35(21-27-23-46-31-16-8-6-14-29(27)31)40(57)51-52-41(58)50-34(20-26-22-45-30-15-7-5-13-28(26)30)39(56)49-33(19-25-11-3-2-4-12-25)38(55)47-32(36(44)53)17-9-10-18-42/h2-8,11-16,22-24,32-35,45-46H,9-10,17-21,42-43H2,1H3,(H2,44,53)(H,47,55)(H,48,54)(H,49,56)(H,51,57)(H2,50,52,58)/t24-,32-,33+,34-,35+/m0/s1
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US Patent
n/an/a 8.76E+3n/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
Estrogen receptor [D538G]


(Homo sapiens (Human))
BDBM50395024
PNG
(CHEMBL2163444 | US9708370, CP-2A(v))
Show SMILES C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C41H51N11O6/c1-24(43)37(54)48-35(21-27-23-46-31-16-8-6-14-29(27)31)40(57)51-52-41(58)50-34(20-26-22-45-30-15-7-5-13-28(26)30)39(56)49-33(19-25-11-3-2-4-12-25)38(55)47-32(36(44)53)17-9-10-18-42/h2-8,11-16,22-24,32-35,45-46H,9-10,17-21,42-43H2,1H3,(H2,44,53)(H,47,55)(H,48,54)(H,49,56)(H,51,57)(H2,50,52,58)/t24-,32-,33+,34-,35+/m0/s1
PDB

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PC cid
PC sid
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US Patent
n/an/a 568n/an/an/an/an/an/a



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

US Patent


Assay Description
GHS-R1a radioreceptor assay using LLCPK-1 membranes overexpressing GSH-R1a and radioiodinated (1-28) rat ghrelin as tracer.


US Patent US9708370 (2017)


BindingDB Entry DOI: 10.7270/Q2XP76ZK
More data for this
Ligand-Target Pair
Platelet glycoprotein 4


(Rattus norvegicus)
BDBM50395024
PNG
(CHEMBL2163444 | US9708370, CP-2A(v))
Show SMILES C[C@H](N)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NNC(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(N)=O |r|
Show InChI InChI=1S/C41H51N11O6/c1-24(43)37(54)48-35(21-27-23-46-31-16-8-6-14-29(27)31)40(57)51-52-41(58)50-34(20-26-22-45-30-15-7-5-13-28(26)30)39(56)49-33(19-25-11-3-2-4-12-25)38(55)47-32(36(44)53)17-9-10-18-42/h2-8,11-16,22-24,32-35,45-46H,9-10,17-21,42-43H2,1H3,(H2,44,53)(H,47,55)(H,48,54)(H,49,56)(H,51,57)(H2,50,52,58)/t24-,32-,33+,34-,35+/m0/s1
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Article
PubMed
n/an/a 6.06E+3n/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