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SMILES: COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(N)cc2n(CCCN2CCN(CC2)C(=O)C=C)c1=O

InChI Key: InChIKey=AGDQTRSAMIIWTQ-UHFFFAOYSA-N

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 2 hits for monomerid = 287554   
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 1


(Homo sapiens (Human))
BDBM287554
PNG
(1-(3-(4-acryloylpiperazin-1-yl)propyl)-7-amino-3-(...)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(N)cc2n(CCCN2CCN(CC2)C(=O)C=C)c1=O |(3.33,8.09,;2,7.32,;2,5.78,;3.33,5,;3.33,3.46,;4.67,2.69,;6,3.46,;2,2.69,;2,1.15,;.67,3.46,;.67,5,;-.67,5.77,;-.67,2.69,;-2,3.46,;-3.33,2.69,;-4.67,3.46,;-6,2.69,;-6,1.15,;-7.34,.38,;-4.67,.38,;-3.33,1.15,;-2,.38,;-2,-1.16,;-.67,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.78,;2,-6.55,;3.33,-5.78,;3.33,-4.24,;2,-3.46,;4.67,-6.55,;4.67,-8.09,;6,-5.78,;7.34,-6.55,;-.67,1.15,;.67,.38,)|
Show InChI InChI=1S/C26H29Cl2N5O4/c1-4-22(34)32-10-8-31(9-11-32)6-5-7-33-18-13-21(29)30-15-16(18)12-17(26(33)35)23-24(27)19(36-2)14-20(37-3)25(23)28/h4,12-15H,1,5-11H2,2-3H3,(H2,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.40n/an/an/an/an/an/a


TBA

Assay Description
A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of FGFR family (FGFR1, FGFR2, FGFR3, FGFR4) kin...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2DB850W
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM287554
PNG
(1-(3-(4-acryloylpiperazin-1-yl)propyl)-7-amino-3-(...)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-c1cc2cnc(N)cc2n(CCCN2CCN(CC2)C(=O)C=C)c1=O |(3.33,8.09,;2,7.32,;2,5.78,;3.33,5,;3.33,3.46,;4.67,2.69,;6,3.46,;2,2.69,;2,1.15,;.67,3.46,;.67,5,;-.67,5.77,;-.67,2.69,;-2,3.46,;-3.33,2.69,;-4.67,3.46,;-6,2.69,;-6,1.15,;-7.34,.38,;-4.67,.38,;-3.33,1.15,;-2,.38,;-2,-1.16,;-.67,-1.93,;-.67,-3.47,;.67,-4.24,;.67,-5.78,;2,-6.55,;3.33,-5.78,;3.33,-4.24,;2,-3.46,;4.67,-6.55,;4.67,-8.09,;6,-5.78,;7.34,-6.55,;-.67,1.15,;.67,.38,)|
Show InChI InChI=1S/C26H29Cl2N5O4/c1-4-22(34)32-10-8-31(9-11-32)6-5-7-33-18-13-21(29)30-15-16(18)12-17(26(33)35)23-24(27)19(36-2)14-20(37-3)25(23)28/h4,12-15H,1,5-11H2,2-3H3,(H2,29,30)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 1.40n/an/an/an/an/a25



Principia Biopharma, Inc.

US Patent


Assay Description
A Caliper-based kinase assay (Caliper Life Sciences, Hopkinton, Mass.) was used to measure inhibition of FGFR family (FGFR1, FGFR2, FGFR3, FGFR4) kin...


US Patent US9567334 (2017)


BindingDB Entry DOI: 10.7270/Q2XK8HKQ
More data for this
Ligand-Target Pair