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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Acid phosphatase (acpA)' and Ligand = 'BDBM92478'   
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
Acid phosphatase (acpA)


(Francisella tularensis)
BDBM92478
PNG
(Atracurium besylate | CHEMBL1360)
Show SMILES COc1ccc(CC2c3cc(OC)c(OC)cc3CC[N+]2(C)CCC(=O)OCCCCCOC(=O)CC[N+]2(C)CCc3cc(OC)c(OC)cc3C2Cc2ccc(OC)c(OC)c2)cc1OC
Show InChI InChI=1S/C53H72N2O12/c1-54(22-18-38-32-48(62-7)50(64-9)34-40(38)42(54)28-36-14-16-44(58-3)46(30-36)60-5)24-20-52(56)66-26-12-11-13-27-67-53(57)21-25-55(2)23-19-39-33-49(63-8)51(65-10)35-41(39)43(55)29-37-15-17-45(59-4)47(31-37)61-6/h14-17,30-35,42-43H,11-13,18-29H2,1-10H3/q+2
KEGG

UniProtKB/TrEMBL

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CHEMBL
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KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
3.42E+5n/an/an/an/an/an/an/an/a



University of Florida



Assay Description
The inhibitor screening assays were performed in 96-well format with 1152 small molecules found in the Prestwick chemical library (Prestwick Chemical...


J Biol Chem 285: 5171-7 (2010)


Article DOI: 10.1074/jbc.M109.039511
BindingDB Entry DOI: 10.7270/Q2348HZQ
More data for this
Ligand-Target Pair