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1 similar compounds to monomer 50006864

Compile data set for download or QSAR
Wt: 699.9
BDBM50022961

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50022961   
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
Renin


(Homo sapiens (Human))
BDBM50022961
PNG
((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...)
Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C
Show InChI InChI=1S/C37H57N5O6S/c1-25(2)16-17-33(44)38-19-18-32(43)29(20-26-12-8-6-9-13-26)40-35(46)31(22-28-23-49-24-39-28)41-34(45)30(21-27-14-10-7-11-15-27)42-36(47)48-37(3,4)5/h7,10-11,14-15,23-26,29-32,43H,6,8-9,12-13,16-22H2,1-5H3,(H,38,44)(H,40,46)(H,41,45)(H,42,47)/t29-,30?,31?,32-/m0/s1
PDB
MMDB

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Similars

Article
PubMed
n/an/a 10n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human renin


J Med Chem 30: 1224-8 (1987)


Article DOI: 10.1021/jm00390a018
BindingDB Entry DOI: 10.7270/Q2X63NJ7
More data for this
Ligand-Target Pair