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BDBM239714 US9394309, 173

SMILES: Cc1ccc(NC(=O)c2cc(F)cc(c2)S(F)(F)(F)(F)F)cc1-n1ccn2nc(cc12)-c1cncs1

InChI Key: InChIKey=BBWORYDJSLWJAU-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 239714   
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
Tyrosine-protein kinase receptor TIE-2


(Homo sapiens (Human))
BDBM239714
PNG
(US9394309, 173)
Show SMILES Cc1ccc(NC(=O)c2cc(F)cc(c2)S(F)(F)(F)(F)F)cc1-n1ccn2nc(cc12)-c1cncs1
Show InChI InChI=1S/C22H15F6N5OS2/c1-13-2-3-16(30-22(34)14-6-15(23)8-17(7-14)36(24,25,26,27)28)9-19(13)32-4-5-33-21(32)10-18(31-33)20-11-29-12-35-20/h2-12H,1H3,(H,30,34)
PDB

GoogleScholar
PC cid
PC sid
UniChem
US Patent
n/an/a 9.30n/an/an/an/a7.022



Bayer Pharma Aktiengesellschaft

US Patent


Assay Description
For the assay, 50 nl of a 100-fold concentrated solution of the respective test substance in DMSO were pipetted into a black low-volume 384-well micr...


US Patent US9394309 (2016)


BindingDB Entry DOI: 10.7270/Q2C53JRC
More data for this
Ligand-Target Pair