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BDBM50096820 (S)-6-Amino-2-((S)-3-(1H-indol-3-yl)-2-{[1-((S)-1-methoxycarbonyl-2-phenyl-ethylcarbamoyl)-piperidine-3-carbonyl]-amino}-butyrylamino)-hexanoic acid tert-butyl ester::CHEMBL132610

SMILES: COC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCCC(C1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C

InChI Key: InChIKey=GOPOKSYQSCTBIU-GRYQFIPSSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50096820   
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
Somatostatin receptor type 2


(Homo sapiens (Human))		BDBM50096820
PNG
((S)-6-Amino-2-((S)-3-(1H-indol-3-yl)-2-{[1-((S)-1-...)
Show SMILES COC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCCC(C1)C(=O)NC([C@@H](C)c1c[nH]c2ccccc12)C(=O)N[C@@H](CCCCN)C(=O)OC(C)(C)C
Show InChI InChI=1S/C39H54N6O7/c1-25(29-23-41-30-18-10-9-17-28(29)30)33(35(47)42-31(19-11-12-20-40)37(49)52-39(2,3)4)44-34(46)27-16-13-21-45(24-27)38(50)43-32(36(48)51-5)22-26-14-7-6-8-15-26/h6-10,14-15,17-18,23,25,27,31-33,41H,11-13,16,19-22,24,40H2,1-5H3,(H,42,47)(H,43,50)(H,44,46)/t25-,27?,31-,32-,33?/m0/s1
PDB

KEGG

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PC cid
PC sid
UniChem

Similars
PubMed
 8.60n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human somatostatin 2 receptor

Bioorg Med Chem Lett 11: 415-7 (2001)


BindingDB Entry DOI: 10.7270/Q2474949
More data for this
Ligand-Target Pair