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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Somatostatin receptor type 2' and Ligand = 'BDBM50215551'   
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 2


(Homo sapiens (Human))		BDBM50215551
PNG
(CHEMBL410194)
Show SMILES [H][C@@]1(NC(=O)[C@H](CCCCNC(=O)OC(C)(C)C)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccc(O)cc2)NC(=O)[C@H](CSSC[C@@H](NC1=O)C(=O)N[C@@H]([C@@H](C)O)C(O)=O)NC(=O)[C@@H](Cc1ccccc1)NC(=O)CN1CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC1)[C@@H](C)O
Show InChI InChI=1S/C70H98N14O21S2/c1-41(85)59-67(101)78-54(66(100)80-60(42(2)86)68(102)103)40-107-106-39-53(77-62(96)50(31-43-13-7-6-8-14-43)73-55(88)35-81-23-25-82(36-56(89)90)27-29-84(38-58(93)94)30-28-83(26-24-81)37-57(91)92)65(99)75-51(32-44-18-20-46(87)21-19-44)63(97)76-52(33-45-34-72-48-16-10-9-15-47(45)48)64(98)74-49(61(95)79-59)17-11-12-22-71-69(104)105-70(3,4)5/h6-10,13-16,18-21,34,41-42,49-54,59-60,72,85-87H,11-12,17,22-33,35-40H2,1-5H3,(H,71,104)(H,73,88)(H,74,98)(H,75,99)(H,76,97)(H,77,96)(H,78,101)(H,79,95)(H,80,100)(H,89,90)(H,91,92)(H,93,94)(H,102,103)/t41-,42-,49+,50-,51+,52+,53+,54-,59-,60+/m1/s1
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PC cid
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Similars
PubMed
 1.30n/an/an/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Binding affinity for SSTR2 receptors of rat cortex membranes was determined by using [125I][Tyr3]-octreotide radioligand

Bioorg Med Chem Lett 8: 1207-10 (1999)


BindingDB Entry DOI: 10.7270/Q2DB834V
More data for this
Ligand-Target Pair