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SMILES: O=C(N1CCC(C1)c1ccncc1)c1cnc2NCCOc2c1

InChI Key: InChIKey=MATIPGURDHMPAL-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 408846   
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))		BDBM408846
PNG
(US10364255, Ex. 38)
Show SMILES O=C(N1CCC(C1)c1ccncc1)c1cnc2NCCOc2c1
Show InChI InChI=1S/C17H18N4O2/c22-17(14-9-15-16(20-10-14)19-6-8-23-15)21-7-3-13(11-21)12-1-4-18-5-2-12/h1-2,4-5,9-10,13H,3,6-8,11H2,(H,19,20)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 14.2n/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