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SMILES: COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1

InChI Key: InChIKey=NCHRMJWKKXNHAK-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 6 hits for monomerid = 350024   
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))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
PDB
MMDB

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PC cid
PC sid
UniChem
US Patent
n/an/a 3.80n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
FGFR1, 2 and 3 kinase activity was measured by the Invitrogen LanthaScreen™ Assay technology which directly measures the amount of substrate phosphor...


US Patent US10208024 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GNW
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
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PC sid
UniChem
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n/an/a 5.5n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
FGFR1, 2 and 3 kinase activity was measured by the Invitrogen LanthaScreen™ Assay technology which directly measures the amount of substrate phosphor...


US Patent US10208024 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GNW
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3 [397-806]


(Homo sapiens (Human))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 2.80n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent




US Patent US10766881 (2020)


BindingDB Entry DOI: 10.7270/Q2BZ693Q
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1 [308-731]


(Homo sapiens (Human))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 3.80n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent


Assay Description
To measure FGFR1 kinase activity, 200 pM His-tagged recombinant human FGFR1 catalytic domain (amino acids 308-731) (Life Technologies Cat. No. PR4660...


US Patent US10766881 (2020)


BindingDB Entry DOI: 10.7270/Q2BZ693Q
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2 [403-822]


(Homo sapiens (Human))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 5.5n/an/an/an/an/an/a



Array Biopharma Inc.

US Patent




US Patent US10766881 (2020)


BindingDB Entry DOI: 10.7270/Q2BZ693Q
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM350024
PNG
(US10208024, Example 23 | US10766881, Example 23)
Show SMILES COc1cc(OC)c(Cl)c(c1Cl)-n1nc(ccc1=O)-c1nc(cnc1N)-c1cnn(C)c1 |(4.62,3.85,;5.96,3.08,;5.96,1.54,;7.29,.77,;7.29,-.77,;8.62,-1.54,;8.62,-3.08,;5.96,-1.54,;5.96,-3.08,;4.62,-.77,;4.62,.77,;3.29,1.54,;3.29,-1.54,;1.95,-.77,;.62,-1.54,;.62,-3.08,;1.95,-3.85,;3.29,-3.08,;4.62,-3.85,;-.71,-.77,;-2.05,-1.54,;-3.38,-.77,;-3.38,.77,;-2.05,1.54,;-.71,.77,;.62,1.54,;-4.71,-1.54,;-4.71,-3.08,;-6.18,-3.56,;-7.08,-2.31,;-8.62,-2.31,;-6.18,-1.06,)|
Show InChI InChI=1S/C20H17Cl2N7O3/c1-28-9-10(7-25-28)12-8-24-20(23)18(26-12)11-4-5-15(30)29(27-11)19-16(21)13(31-2)6-14(32-3)17(19)22/h4-9H,1-3H3,(H2,23,24)
PDB
MMDB

Reactome pathway
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UniProtKB/SwissProt

B.MOAD
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antibodypedia
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PC cid
PC sid
UniChem
US Patent
n/an/a 2.80n/an/an/an/an/an/a



Array BioPharma Inc.

US Patent


Assay Description
FGFR1, 2 and 3 kinase activity was measured by the Invitrogen LanthaScreen™ Assay technology which directly measures the amount of substrate phosphor...


US Patent US10208024 (2019)


BindingDB Entry DOI: 10.7270/Q2CJ8GNW
More data for this
Ligand-Target Pair