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BDBM50303779 (S)-5-guanidino-N-((S)-1-((S)-5-guanidino-1-(3-(guanidinomethyl)benzylamino)-1-oxopentan-2-ylamino)-3-methyl-1-oxobutan-2-yl)-2-(2-phenylacetamido)pentanamide::CHEMBL566347

SMILES: [#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1

InChI Key: InChIKey=KLZSMSSPKKYZOI-NSVAZKTRSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50303779   
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
Homo sapiens furin (paired basic amino acid cleaving enzyme) (FURIN), mRNA


(Homo sapiens (Human))		BDBM50303779
PNG
((S)-5-guanidino-N-((S)-1-((S)-5-guanidino-1-(3-(gu...)
Show SMILES [#6]-[#6](-[#6])-[#6@H](-[#7]-[#6](=O)-[#6@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#7]-[#6](=O)-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]\[#7]=[#6](/[#7])-[#7])-[#6](=O)-[#7]-[#6]-c1cccc(-[#6]\[#7]=[#6](\[#7])-[#7])c1 |r|
Show InChI InChI=1S/C34H53N13O4/c1-21(2)28(47-30(50)26(14-8-16-42-33(37)38)45-27(48)18-22-9-4-3-5-10-22)31(51)46-25(13-7-15-41-32(35)36)29(49)43-19-23-11-6-12-24(17-23)20-44-34(39)40/h3-6,9-12,17,21,25-26,28H,7-8,13-16,18-20H2,1-2H3,(H,43,49)(H,45,48)(H,46,51)(H,47,50)(H4,35,36,41)(H4,37,38,42)(H4,39,40,44)/t25-,26-,28-/m0/s1
PDB

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PC cid
PC sid
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Similars
Article
PubMed
 2.73E+3n/an/an/an/an/an/an/an/a



Philipps University Marburg

Curated by ChEMBL


Assay Description
Inhibition of human furin by fluorescence assay

J Med Chem 53: 1067-75 (2010)


Article DOI: 10.1021/jm9012455
BindingDB Entry DOI: 10.7270/Q2DN455Q
More data for this
Ligand-Target Pair