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SMILES: CN1C(=O)CCC11CCN(C1)C(=O)c1cnc2NC3(CC3)CCOc2c1

InChI Key: InChIKey=VBVPSRUUWNTMGI-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 408836   
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
Pantetheinase


(Homo sapiens (Human))		BDBM408836
PNG
(US10364255, Ex. 27)
Show SMILES CN1C(=O)CCC11CCN(C1)C(=O)c1cnc2NC3(CC3)CCOc2c1
Show InChI InChI=1S/C19H24N4O3/c1-22-15(24)2-3-19(22)6-8-23(12-19)17(25)13-10-14-16(20-11-13)21-18(4-5-18)7-9-26-14/h10-11H,2-9,12H2,1H3,(H,20,21)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.09n/an/an/an/an/an/a



Boehringer Ingleheim International GmbH

US Patent


Assay Description
Method 1:Vanin-1 Enzymatic Assay:The test compounds are dissolved in 100% DMSO at a concentration of 10 mM and in a first step diluted in DMSO to a c...

US Patent US10364255 (2019)


BindingDB Entry DOI: 10.7270/Q28S4S8N
More data for this
Ligand-Target Pair