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SMILES: COCCOc1cc(NC(=O)N2CCCc3cc(CO)c(C=O)nc23)ncc1C#N

InChI Key: InChIKey=RVTLBVODLXUYNU-UHFFFAOYSA-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 4 hits for monomerid = 209281   
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 [388-802]


(Homo sapiens (Human))
BDBM209281
PNG
(US9266883, 39)
Show SMILES COCCOc1cc(NC(=O)N2CCCc3cc(CO)c(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H21N5O5/c1-29-5-6-30-17-8-18(22-10-15(17)9-21)24-20(28)25-4-2-3-13-7-14(11-26)16(12-27)23-19(13)25/h7-8,10,12,26H,2-6,11H2,1H3,(H,22,24,28)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.20n/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))
BDBM209281
PNG
(US9266883, 39)
Show SMILES COCCOc1cc(NC(=O)N2CCCc3cc(CO)c(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H21N5O5/c1-29-5-6-30-17-8-18(22-10-15(17)9-21)24-20(28)25-4-2-3-13-7-14(11-26)16(12-27)23-19(13)25/h7-8,10,12,26H,2-6,11H2,1H3,(H,22,24,28)
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 3.20n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Mus musculus)
BDBM209281
PNG
(US9266883, 39)
Show SMILES COCCOc1cc(NC(=O)N2CCCc3cc(CO)c(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H21N5O5/c1-29-5-6-30-17-8-18(22-10-15(17)9-21)24-20(28)25-4-2-3-13-7-14(11-26)16(12-27)23-19(13)25/h7-8,10,12,26H,2-6,11H2,1H3,(H,22,24,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 8.70n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 4


(Mus musculus)
BDBM209281
PNG
(US9266883, 39)
Show SMILES COCCOc1cc(NC(=O)N2CCCc3cc(CO)c(C=O)nc23)ncc1C#N
Show InChI InChI=1S/C20H21N5O5/c1-29-5-6-30-17-8-18(22-10-15(17)9-21)24-20(28)25-4-2-3-13-7-14(11-26)16(12-27)23-19(13)25/h7-8,10,12,26H,2-6,11H2,1H3,(H,22,24,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
n/an/a 9.5n/an/an/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair