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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Somatostatin receptor type 3' and Ligand = 'BDBM50261387'   
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 3


(Homo sapiens (Human))		BDBM50261387
PNG
(CHEMBL455760 | H-Cpa2-c[DHcy3-Tyr7-DTrp8-Lys9-Thr1...)
Show SMILES C[C@@H](O)[C@@H]1NC(=O)[C@H](CCCCN)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CCSSCC[C@@H](NC1=O)C(=O)N[C@@H](Cc1ccc2ccccc2c1)C(N)=O)NC(=O)[C@H](N)Cc1c[nH]c(c1)C(O)=O |r|
Show InChI InChI=1S/C59H72N12O12S2/c1-32(72)50-58(81)67-45(53(76)68-46(51(62)74)27-34-13-16-36-8-2-3-9-37(36)24-34)20-23-85-84-22-19-44(65-52(75)41(61)25-35-28-49(59(82)83)63-30-35)54(77)69-47(26-33-14-17-39(73)18-15-33)56(79)70-48(29-38-31-64-42-11-5-4-10-40(38)42)57(80)66-43(55(78)71-50)12-6-7-21-60/h2-5,8-11,13-18,24,28,30-32,41,43-48,50,63-64,72-73H,6-7,12,19-23,25-27,29,60-61H2,1H3,(H2,62,74)(H,65,75)(H,66,80)(H,67,81)(H,68,76)(H,69,77)(H,70,79)(H,71,78)(H,82,83)/t32-,41-,43+,44+,45-,46+,47+,48-,50+/m1/s1
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Similars
Article
PubMed
n/an/a 359n/an/an/an/an/an/a



Salk Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]-[Leu8, DTrp22, Tyr25]SRIF28 from human sst3 receptor expressed in chinese hamster CCL39 cells by autoradiography

J Med Chem 51: 2676-81 (2008)


Article DOI: 10.1021/jm701445q
BindingDB Entry DOI: 10.7270/Q2H70GQW
More data for this
Ligand-Target Pair