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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'RAC-alpha serine/threonine-protein kinase [E17K]' and Ligand = 'BDBM431880'   
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
RAC-alpha serine/threonine-protein kinase [E17K]


(Homo sapiens (Human))		BDBM431880
PNG
(US10550114, Compound 45)
Show SMILES O=C(Nc1cccc(c1)C(=O)NC1CCN(Cc2ccc(cc2)-c2nc3cc[nH]c(=O)c3cc2-c2ccccc2)CC1)C(=C\C1CC1)\C#N
Show InChI InChI=1S/C40H36N6O3/c41-24-31(21-26-9-10-26)39(48)44-33-8-4-7-30(22-33)38(47)43-32-16-19-46(20-17-32)25-27-11-13-29(14-12-27)37-34(28-5-2-1-3-6-28)23-35-36(45-37)15-18-42-40(35)49/h1-8,11-15,18,21-23,26,32H,9-10,16-17,19-20,25H2,(H,42,49)(H,43,47)(H,44,48)/b31-21+
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.37E+4n/an/an/an/an/an/a



TECHNISCHE UNIVERSITÄT DORTMUND

US Patent


Assay Description
iFLiK and HTRF studies were carried out as described in Z. Fang, J. R. Simard, D. Plenker, H. D. Nguyen, T. Phan, P. Wolle, S. Baumeister, D. Rauh, A...

US Patent US10550114 (2020)


BindingDB Entry DOI: 10.7270/Q2DV1N97
More data for this
Ligand-Target Pair