BindingDB logo
myBDB logout

null

SMILES: CN(C)[C@H]1CCN(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)C1

InChI Key: InChIKey=NQDLGVGBZZVLHJ-QHCPKHFHSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 174186   
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
TRAF2 and NCK-interacting protein kinase


(Homo sapiens (Human))		BDBM174186
PNG
(US9102637, 221)
Show SMILES CN(C)[C@H]1CCN(Cc2ccc(cc2)C(=O)Nc2sc(Nc3ccc4ccccc4c3)nc2C(N)=O)C1 |r|
Show InChI InChI=1S/C28H30N6O2S/c1-33(2)23-13-14-34(17-23)16-18-7-9-20(10-8-18)26(36)32-27-24(25(29)35)31-28(37-27)30-22-12-11-19-5-3-4-6-21(19)15-22/h3-12,15,23H,13-14,16-17H2,1-2H3,(H2,29,35)(H,30,31)(H,32,36)/t23-/m0/s1
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars
US Patent
n/an/a 2.60n/an/an/an/a7.525



CARNA BIOSCIENCES, INC.; NATIONAL CANCER CENTER

US Patent


Assay Description
The kinase assays were conducted in a 20 μl volume using 384-well plates (Greiner). The reaction mixture consists of compound or vehicle (1% DMS...

US Patent US9102637 (2015)


BindingDB Entry DOI: 10.7270/Q2KS6Q9T
More data for this
Ligand-Target Pair