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BDBM209280 US9266883, 38

SMILES: CN(C)CCOc1cc(NC(=O)N2CCCc3ccc(C=O)nc23)ncc1C#N

InChI Key: InChIKey=XLGUWBQKZJAXCG-UHFFFAOYSA-N

Data: 3 IC50

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 3 hits for monomerid = 209280   
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
Fibroblast growth factor receptor 4 (FGFR4)


(Homo sapiens (Human))
BDBM209280
PNG
(US9266883, 38)
Show SMILES CN(C)CCOc1cc(NC(=O)N2CCCc3ccc(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H22N6O3/c1-25(2)8-9-29-17-10-18(22-12-15(17)11-21)24-20(28)26-7-3-4-14-5-6-16(13-27)23-19(14)26/h5-6,10,12-13H,3-4,7-9H2,1-2H3,(H,22,24,28)
PDB

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 10.6n/an/an/an/a7.530



Novartis AG

US Patent


Assay Description
Liquid handling and incubation steps were done on an Innovadyne Nanodrop Express equipped with a robotic arm (Thermo CatX, Caliper Twister II) and an...


US Patent US9266883 (2016)


BindingDB Entry DOI: 10.7270/Q2CC0ZGP
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Homo sapiens (Human))
BDBM209280
PNG
(US9266883, 38)
Show SMILES CN(C)CCOc1cc(NC(=O)N2CCCc3ccc(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H22N6O3/c1-25(2)8-9-29-17-10-18(22-12-15(17)11-21)24-20(28)26-7-3-4-14-5-6-16(13-27)23-19(14)26/h5-6,10,12-13H,3-4,7-9H2,1-2H3,(H,22,24,28)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 588n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of TEL-fused FGFR4 cytoplasmic/juxta membrane domain (unknown origin) expressed in mouse Ba/F3 cells assessed as reduction in FGFR4 autoph...


ACS Med Chem Lett 9: 215-220 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00485
BindingDB Entry DOI: 10.7270/Q27947C7
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Homo sapiens (Human))
BDBM209280
PNG
(US9266883, 38)
Show SMILES CN(C)CCOc1cc(NC(=O)N2CCCc3ccc(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H22N6O3/c1-25(2)8-9-29-17-10-18(22-12-15(17)11-21)24-20(28)26-7-3-4-14-5-6-16(13-27)23-19(14)26/h5-6,10,12-13H,3-4,7-9H2,1-2H3,(H,22,24,28)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 11n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of FGFR4 (388 to 802 residues) (unknown origin) using 5-Fluo-Ahx-KKKKEEIYFFFG-NH2 as substrate after 60 mins by microfluidic mobility shif...


ACS Med Chem Lett 9: 215-220 (2018)


Article DOI: 10.1021/acsmedchemlett.7b00485
BindingDB Entry DOI: 10.7270/Q27947C7
More data for this
Ligand-Target Pair