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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Proto-oncogene tyrosine-protein kinase Src' and Ligand = 'BDBM205311'   
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
Proto-oncogene tyrosine-protein kinase Src


(Homo sapiens (Human))
BDBM205311
PNG
(US9249125, 64)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(Nc4ccc5CS(=O)(=O)Cc5c4)n3)c3ccccc23)n(n1)-c1ccc(OCCN2CCOCC2)cc1
Show InChI InChI=1S/C42H44N8O6S/c1-42(2,3)37-25-38(50(48-37)31-10-12-32(13-11-31)55-23-20-49-18-21-54-22-19-49)46-41(51)45-35-14-15-36(34-7-5-4-6-33(34)35)56-39-16-17-43-40(47-39)44-30-9-8-28-26-57(52,53)27-29(28)24-30/h4-17,24-25H,18-23,26-27H2,1-3H3,(H,43,44,47)(H2,45,46,51)
PDB
MMDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
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US Patent
n/an/a 3n/an/an/an/an/an/a



RESPIVERT LIMITED; TOPIVERT PHARMA LIMITED

US Patent


Assay Description
The inhibitory activities of compounds of the invention against c-Src and Syk enzymes (Invitrogen), are evaluated in a similar fashion to that descri...


US Patent US9249125 (2016)


BindingDB Entry DOI: 10.7270/Q2CN72QG
More data for this
Ligand-Target Pair