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Compile Data Set for Download or QSAR

Found 169 hits with Last Name = 'lipner' and Initial = 'j'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587623
PNG
(CHEMBL5173892)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1 |r|
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n/an/a 0.110n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50065454
PNG
(CHEBI:63453 | CHEMBL3348846)
Show SMILES COc1cc(CCc2cc(NC(=O)c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)n[nH]2)cc(OC)c1
Show InChI InChI=1S/C26H33N5O3/c1-17-15-31(16-18(2)27-17)22-9-6-20(7-10-22)26(32)28-25-13-21(29-30-25)8-5-19-11-23(33-3)14-24(12-19)34-4/h6-7,9-14,17-18,27H,5,8,15-16H2,1-4H3,(H2,28,29,30,32)/t17-,18+
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587622
PNG
(CHEMBL5171314)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(F)c(cc3[nH]2)N2CCOCC2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587621
PNG
(CHEMBL5179660)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(F)c(cc3[nH]2)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1 |r|
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM301310
PNG
(3-(2,6-difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-(mo...)
Show SMILES CCN1C(=O)N(Cc2cnc3[nH]c(CN4CCOCC4)cc3c12)c1c(F)c(OC)cc(OC)c1F
Show InChI InChI=1S/C24H27F2N5O4/c1-4-30-21-14(11-27-23-16(21)9-15(28-23)13-29-5-7-35-8-6-29)12-31(24(30)32)22-19(25)17(33-2)10-18(34-3)20(22)26/h9-11H,4-8,12-13H2,1-3H3,(H,27,28)
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587619
PNG
(CHEMBL5205436)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)c1Cl
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n/an/a 0.430n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587619
PNG
(CHEMBL5205436)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)c1Cl
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n/an/a 0.430n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587620
PNG
(CHEMBL5189958)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(F)c(cc3[nH]2)N2CCN(C)CC2)cc(OC)c1
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n/an/a 0.437n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587625
PNG
(CHEMBL5199374)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM301310
PNG
(3-(2,6-difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-(mo...)
Show SMILES CCN1C(=O)N(Cc2cnc3[nH]c(CN4CCOCC4)cc3c12)c1c(F)c(OC)cc(OC)c1F
Show InChI InChI=1S/C24H27F2N5O4/c1-4-30-21-14(11-27-23-16(21)9-15(28-23)13-29-5-7-35-8-6-29)12-31(24(30)32)22-19(25)17(33-2)10-18(34-3)20(22)26/h9-11H,4-8,12-13H2,1-3H3,(H,27,28)
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587646
PNG
(CHEMBL5177815)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCN(C)CC4)cc3[nH]2)c1Cl
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587625
PNG
(CHEMBL5199374)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587646
PNG
(CHEMBL5177815)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCN(C)CC4)cc3[nH]2)c1Cl
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n/an/a 0.790n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587631
PNG
(CHEMBL5191338)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587630
PNG
(CHEMBL5174735)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCN(C)CC4)cc3[nH]2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587628
PNG
(CHEMBL5186357)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCC(CC4)N4CCN(C)CC4)cc3[nH]2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587626
PNG
(CHEMBL5207255)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCOCC2)cc(OC)c1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342461
PNG
(US9776988, Example 21)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)
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US Patent
n/an/a 0.950n/an/an/an/an/an/a



Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM301310
PNG
(3-(2,6-difluoro-3,5-dimethoxyphenyl)-1-ethyl-8-(mo...)
Show SMILES CCN1C(=O)N(Cc2cnc3[nH]c(CN4CCOCC4)cc3c12)c1c(F)c(OC)cc(OC)c1F
Show InChI InChI=1S/C24H27F2N5O4/c1-4-30-21-14(11-27-23-16(21)9-15(28-23)13-29-5-7-35-8-6-29)12-31(24(30)32)22-19(25)17(33-2)10-18(34-3)20(22)26/h9-11H,4-8,12-13H2,1-3H3,(H,27,28)
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587647
PNG
(CHEMBL5186648)
Show SMILES O=C(NC1CC1)c1c[nH]nc1-c1nc2cc(CN3CCOCC3)ccc2[nH]1
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342487
PNG
(US9776988, Example 3)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)
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US Patent
n/an/a 1.07n/an/an/an/an/an/a



Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342487
PNG
(US9776988, Example 3)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NC2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C26H29N5O4/c1-33-20-11-16(12-21(15-20)34-2)3-5-19-14-24(31-30-19)25-28-22-6-4-17(13-23(22)29-25)26(32)27-18-7-9-35-10-8-18/h4,6,11-15,18H,3,5,7-10H2,1-2H3,(H,27,32)(H,28,29)(H,30,31)
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50587619
PNG
(CHEMBL5205436)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)c1Cl
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TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50525939
PNG
(Balversa | Erdafitinib | Jnj-42756493)
Show SMILES COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(nc2c1)-c1cnn(C)c1
Show InChI InChI=1S/C25H30N6O2/c1-17(2)26-8-9-31(20-10-21(32-4)13-22(11-20)33-5)19-6-7-23-24(12-19)29-25(15-27-23)18-14-28-30(3)16-18/h6-7,10-17,26H,8-9H2,1-5H3
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342463
PNG
(US9776988, Example 27)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccn(CCN3CCOCC3)n2)cc(OC)c1
Show InChI InChI=1S/C29H33N7O3/c1-37-23-15-20(16-24(19-23)38-2)3-5-22-18-28(33-32-22)29-30-26-6-4-21(17-27(26)31-29)25-7-8-36(34-25)10-9-35-11-13-39-14-12-35/h4,6-8,15-19H,3,5,9-14H2,1-2H3,(H,30,31)(H,32,33)
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n/an/a 1.26n/an/an/an/an/an/a



Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587637
PNG
(CHEMBL5192921)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)-c2ccc(cc2)C(=O)N2CCOCC2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587627
PNG
(CHEMBL5201819)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCC(CC4)N4CCNCC4)cc3[nH]2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342456
PNG
(US9776988, Example 14)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(CN4CCN(CCN5CCOCC5)CC4)ccc3[nH]2)cc(OC)c1
Show InChI InChI=1S/C31H41N7O3/c1-39-26-17-23(18-27(21-26)40-2)3-5-25-20-30(35-34-25)31-32-28-6-4-24(19-29(28)33-31)22-38-11-9-36(10-12-38)7-8-37-13-15-41-16-14-37/h4,6,17-21H,3,5,7-16,22H2,1-2H3,(H,32,33)(H,34,35)
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n/an/a 1.63n/an/an/an/an/an/a



Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50065454
PNG
(CHEBI:63453 | CHEMBL3348846)
Show SMILES COc1cc(CCc2cc(NC(=O)c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)n[nH]2)cc(OC)c1
Show InChI InChI=1S/C26H33N5O3/c1-17-15-31(16-18(2)27-17)22-9-6-20(7-10-22)26(32)28-25-13-21(29-30-25)8-5-19-11-23(33-3)14-24(12-19)34-4/h6-7,9-14,17-18,27H,5,8,15-16H2,1-4H3,(H2,28,29,30,32)/t17-,18+
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587632
PNG
(CHEMBL5191301)
Show SMILES CCN1CCN(CC1)C(=O)c1ccc2nc([nH]c2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM339992
PNG
(US9776988, Example 18)
Show SMILES CCN1CCN(CC1)c1ccc2[nH]c(nc2c1)-c1cc(CCc2cc(OC)cc(OC)c2)[nH]n1
Show InChI InChI=1S/C26H32N6O2/c1-4-31-9-11-32(12-10-31)20-7-8-23-24(16-20)28-26(27-23)25-15-19(29-30-25)6-5-18-13-21(33-2)17-22(14-18)34-3/h7-8,13-17H,4-6,9-12H2,1-3H3,(H,27,28)(H,29,30)
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Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587633
PNG
(CHEMBL5183603)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM340025
PNG
(US9776988, Example 8)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCN(C)CC2)cc(OC)c1
Show InChI InChI=1S/C26H30N6O3/c1-31-8-10-32(11-9-31)26(33)18-5-7-22-23(14-18)28-25(27-22)24-15-19(29-30-24)6-4-17-12-20(34-2)16-21(13-17)35-3/h5,7,12-16H,4,6,8-11H2,1-3H3,(H,27,28)(H,29,30)
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Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342472
PNG
(US9776988, Example 4)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)
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Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM340013
PNG
(US9776988, Example 2)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3cc(ccc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C25H27N5O4/c1-32-19-11-16(12-20(15-19)33-2)3-5-18-14-23(29-28-18)24-26-21-6-4-17(13-22(21)27-24)25(31)30-7-9-34-10-8-30/h4,6,11-15H,3,5,7-10H2,1-2H3,(H,26,27)(H,28,29)
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Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM342472
PNG
(US9776988, Example 4)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)NCCN2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C27H32N6O4/c1-35-21-13-18(14-22(17-21)36-2)3-5-20-16-25(32-31-20)26-29-23-6-4-19(15-24(23)30-26)27(34)28-7-8-33-9-11-37-12-10-33/h4,6,13-17H,3,5,7-12H2,1-2H3,(H,28,34)(H,29,30)(H,31,32)
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587634
PNG
(CHEMBL5183691)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)C(=O)N2CCOCC2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587629
PNG
(CHEMBL5180534)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4C[C@H](C)N[C@H](C)C4)cc3[nH]2)cc(OC)c1 |r|
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587624
PNG
(CHEMBL5182544)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2C[C@H](C)N[C@H](C)C2)cc(OC)c1 |r|
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50065454
PNG
(CHEBI:63453 | CHEMBL3348846)
Show SMILES COc1cc(CCc2cc(NC(=O)c3ccc(cc3)N3C[C@H](C)N[C@H](C)C3)n[nH]2)cc(OC)c1
Show InChI InChI=1S/C26H33N5O3/c1-17-15-31(16-18(2)27-17)22-9-6-20(7-10-22)26(32)28-25-13-21(29-30-25)8-5-19-11-23(33-3)14-24(12-19)34-4/h6-7,9-14,17-18,27H,5,8,15-16H2,1-4H3,(H2,28,29,30,32)/t17-,18+
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50525939
PNG
(Balversa | Erdafitinib | Jnj-42756493)
Show SMILES COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(nc2c1)-c1cnn(C)c1
Show InChI InChI=1S/C25H30N6O2/c1-17(2)26-8-9-31(20-10-21(32-4)13-22(11-20)33-5)19-6-7-23-24(12-19)29-25(15-27-23)18-14-28-30(3)16-18/h6-7,10-17,26H,8-9H2,1-5H3
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Fibroblast growth factor receptor 2


(Homo sapiens (Human))
BDBM50587643
PNG
(CHEMBL5207581)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccccc3[nH]2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50525939
PNG
(Balversa | Erdafitinib | Jnj-42756493)
Show SMILES COc1cc(OC)cc(c1)N(CCNC(C)C)c1ccc2ncc(nc2c1)-c1cnn(C)c1
Show InChI InChI=1S/C25H30N6O2/c1-17(2)26-8-9-31(20-10-21(32-4)13-22(11-20)33-5)19-6-7-23-24(12-19)29-25(15-27-23)18-14-28-30(3)16-18/h6-7,10-17,26H,8-9H2,1-5H3
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50587625
PNG
(CHEMBL5199374)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(C)CC2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM50587646
PNG
(CHEMBL5177815)
Show SMILES COc1cc(OC)c(Cl)c(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCN(C)CC4)cc3[nH]2)c1Cl
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM342461
PNG
(US9776988, Example 21)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCN(CC2)C(=O)N2CCOCC2)cc(OC)c1
Show InChI InChI=1S/C29H35N7O4/c1-38-23-15-20(16-24(19-23)39-2)3-4-21-17-27(33-32-21)28-30-25-6-5-22(18-26(25)31-28)34-7-9-35(10-8-34)29(37)36-11-13-40-14-12-36/h5-6,15-19H,3-4,7-14H2,1-2H3,(H,30,31)(H,32,33)
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Celon Pharma S.A.

US Patent


Assay Description
The compounds were dissolved in 100% DMSO, and obtained solutions were serially diluted in reaction buffer (50 mM Tris pH 7.5, 10 mM MgCl2, 0.25 mM E...


US Patent US9776988 (2017)


BindingDB Entry DOI: 10.7270/Q27946S6
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587626
PNG
(CHEMBL5207255)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2CCOCC2)cc(OC)c1
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Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587631
PNG
(CHEMBL5191338)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCOCC4)cc3[nH]2)cc(OC)c1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.80n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587630
PNG
(CHEMBL5174735)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(CN4CCN(C)CC4)cc3[nH]2)cc(OC)c1
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.90n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50587623
PNG
(CHEMBL5173892)
Show SMILES COc1cc(CCc2cc(n[nH]2)-c2nc3ccc(cc3[nH]2)N2C[C@H](C)O[C@H](C)C2)cc(OC)c1 |r|
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 4.10n/an/an/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112990
BindingDB Entry DOI: 10.7270/Q2WD44HQ
More data for this
Ligand-Target Pair
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