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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 = 'BDBM50075289'   
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


(MOUSE)		BDBM50075289
PNG
(1-[5-amino-1-methyloxycarbonyl-(1R)-pentylcarbamoy...)
Show SMILES COC(=O)[C@@H](CCCCN)NC(=O)[C@@H](Cc1c[nH]c2ccccc12)OC(=O)N1CCC2(CCc3ccccc23)CC1
Show InChI InChI=1S/C32H40N4O5/c1-40-30(38)27(12-6-7-17-33)35-29(37)28(20-23-21-34-26-11-5-3-9-24(23)26)41-31(39)36-18-15-32(16-19-36)14-13-22-8-2-4-10-25(22)32/h2-5,8-11,21,27-28,34H,6-7,12-20,33H2,1H3,(H,35,37)/t27-,28-/m1/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PubMed
 10n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity of the compound was evaluated against mouse Somatostatin receptor type 2 (mSSTR-2)

Bioorg Med Chem Lett 9: 491-6 (1999)


BindingDB Entry DOI: 10.7270/Q2FB5235
More data for this
Ligand-Target Pair