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SMILES: CCCC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O

InChI Key: InChIKey=AJFDPFJFPPPGKD-DNBONZEVSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50517284   
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))
BDBM50517284
PNG
(CHEMBL4581511)
Show SMILES CCCC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
Show InChI InChI=1S/C41H59N11O7/c1-3-4-15-28(42)36(55)51-34(24(2)53)40(59)52-20-11-18-33(52)39(58)50-31(21-25-12-6-5-7-13-25)37(56)49-32(22-26-23-47-29-16-9-8-14-27(26)29)38(57)48-30(35(43)54)17-10-19-46-41(44)45/h5-9,12-14,16,23-24,28,30-34,47,53H,3-4,10-11,15,17-22,42H2,1-2H3,(H2,43,54)(H,48,57)(H,49,56)(H,50,58)(H,51,55)(H4,44,45,46)/t24-,28+,30+,31+,32+,33+,34+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
55n/an/an/an/an/an/an/an/a



Universit£ de Montpellier

Curated by ChEMBL


Assay Description
Displacement of [125I]-His9 ghrelin from SNAP-tagged human GHSR expressed in HEK293T cells after 3 hrs by HTRF assay


J Med Chem 62: 965-973 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01644
More data for this
Ligand-Target Pair
Growth hormone secretagogue receptor type 1


(Homo sapiens (Human))
BDBM50517284
PNG
(CHEMBL4581511)
Show SMILES CCCC[C@H](N)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O |r|
Show InChI InChI=1S/C41H59N11O7/c1-3-4-15-28(42)36(55)51-34(24(2)53)40(59)52-20-11-18-33(52)39(58)50-31(21-25-12-6-5-7-13-25)37(56)49-32(22-26-23-47-29-16-9-8-14-27(26)29)38(57)48-30(35(43)54)17-10-19-46-41(44)45/h5-9,12-14,16,23-24,28,30-34,47,53H,3-4,10-11,15,17-22,42H2,1-2H3,(H2,43,54)(H,48,57)(H,49,56)(H,50,58)(H,51,55)(H4,44,45,46)/t24-,28+,30+,31+,32+,33+,34+/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 6.63E+3n/an/an/an/a



Universit£ de Montpellier

Curated by ChEMBL


Assay Description
Inverse agonist activity at SNAP-tagged human GHSR expressed in HEK293T cells assessed as reduction in inositol phosphate production after 30 mins by...


J Med Chem 62: 965-973 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01644
More data for this
Ligand-Target Pair