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SMILES: COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O)cc1

InChI Key: InChIKey=KPPHIRYHJPMQHU-GLGKVNTQSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50165588   
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))
BDBM50165588
PNG
(CHEMBL3800422)
Show SMILES COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O)cc1 |r|
Show InChI InChI=1S/C48H61N9O6/c1-28(2)21-41(51-30(5)58)45(59)53-42(22-29(3)4)46(60)52-39(23-32-25-49-37-15-11-9-13-35(32)37)43-55-56-44(57(43)27-31-17-19-34(63-8)20-18-31)40(54-47(61)48(6,7)62)24-33-26-50-38-16-12-10-14-36(33)38/h9-20,25-26,28-29,39-42,49-50,62H,21-24,27H2,1-8H3,(H,51,58)(H,52,60)(H,53,59)(H,54,61)/t39-,40-,41+,42+/m1/s1
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PC cid
PC sid
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Similars

Article
PubMed
3 -11.6n/an/an/an/an/an/a25



Universit£ de Montpellier

Curated by ChEMBL


Assay Description
Competitive binding affinity to human SNAP-tagged GHS-R1a expressed in HEK293T cells incubated at 4 degC for 3 hrs or at room temperature for 1 hr by...


Bioorg Med Chem Lett 26: 2408-12 (2016)


Article DOI: 10.1016/j.bmcl.2016.04.003
BindingDB Entry DOI: 10.7270/Q2J9688V
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))
BDBM50165588
PNG
(CHEMBL3800422)
Show SMILES COc1ccc(Cn2c(nnc2[C@@H](Cc2c[nH]c3ccccc23)NC(=O)C(C)(C)O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(C)=O)cc1 |r|
Show InChI InChI=1S/C48H61N9O6/c1-28(2)21-41(51-30(5)58)45(59)53-42(22-29(3)4)46(60)52-39(23-32-25-49-37-15-11-9-13-35(32)37)43-55-56-44(57(43)27-31-17-19-34(63-8)20-18-31)40(54-47(61)48(6,7)62)24-33-26-50-38-16-12-10-14-36(33)38/h9-20,25-26,28-29,39-42,49-50,62H,21-24,27H2,1-8H3,(H,51,58)(H,52,60)(H,53,59)(H,54,61)/t39-,40-,41+,42+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 74n/an/an/an/a



Universit£ de Montpellier

Curated by ChEMBL


Assay Description
Agonist activity at human GHS-R1a expressed in HEK293T cells after 45 mins by HTRF-based IP3 turnover assay


Bioorg Med Chem Lett 26: 2408-12 (2016)


Article DOI: 10.1016/j.bmcl.2016.04.003
BindingDB Entry DOI: 10.7270/Q2J9688V
More data for this
Ligand-Target Pair