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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Somatostatin receptor type 4' and Ligand = 'BDBM50098612'   
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
Somatostatin receptor type 4


(Homo sapiens (Human))		BDBM50098612
PNG
(10-(4-Amino-butyl)-16-benzyl-7-(1-hydroxy-ethyl)-1...)
Show SMILES CN[C@H](Cc1ccccc1)C(=O)N[C@@H]1CSSC[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC1=O)[C@@H](C)O)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
Show InChI InChI=1S/C50H67N11O10S2/c1-28(62)41(43(52)64)60-49(70)40-27-73-72-26-39(58-45(66)36(53-3)22-30-14-6-4-7-15-30)48(69)56-37(23-31-16-8-5-9-17-31)46(67)57-38(24-32-25-54-34-19-11-10-18-33(32)34)47(68)55-35(20-12-13-21-51)44(65)61-42(29(2)63)50(71)59-40/h4-11,14-19,25,28-29,35-42,53-54,62-63H,12-13,20-24,26-27,51H2,1-3H3,(H2,52,64)(H,55,68)(H,56,69)(H,57,67)(H,58,66)(H,59,71)(H,60,70)(H,61,65)/t28-,29-,35+,36-,37+,38+,39-,40+,41+,42+/m1/s1
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PC cid
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Similars
PubMed
n/an/an/a>1.00E+3n/an/an/an/an/a



Tulane University Health Sciences Center

Curated by ChEMBL


Assay Description
Binding affinity was determined on cloned human somatostatin receptor-1 (hsst4)

J Med Chem 44: 1416-21 (2001)


BindingDB Entry DOI: 10.7270/Q2M044QS
More data for this
Ligand-Target Pair