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Compile Data Set for Download or QSAR

Found 223 hits Enz. Inhib. hit(s) with Target = 'Epithelial discoidin domain-containing receptor 1' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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n/an/a 0.5n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1b (unknown origin) assessed as reduction in collagen-induced DDR1b activation


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM185584
PNG
(US9156852, 1)
Show SMILES Cc1ccc2c(Nc3ccc(Cl)cc3)nccc2c1NC(=O)c1csc2c(N)ncnc12
Show InChI InChI=1S/C23H17ClN6OS/c1-12-2-7-16-15(8-9-26-22(16)29-14-5-3-13(24)4-6-14)18(12)30-23(31)17-10-32-20-19(17)27-11-28-21(20)25/h2-11H,1H3,(H,26,29)(H,30,31)(H2,25,27,28)
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US Patent
n/an/a 2n/an/an/an/an/an/a



HANMI PHARM. CO., LTD

US Patent


Assay Description
The compounds prepared in Examples were tested for inhibitory activity against FMS, DDR1 and DDR2 kinases using Kinase Screening and Profiling Servic...


US Patent US9156852 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430865
PNG
(CHEMBL2336037)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C22H15ClN4O/c1-15-5-7-18(22(28)26-20-4-2-3-19(23)12-20)11-17(15)8-6-16-13-24-21-9-10-25-27(21)14-16/h2-5,7,9-14H,1H3,(H,26,28)
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n/an/a 2.30n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50237710
PNG
(4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifl...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)
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n/an/a 3.70n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of DDR1 expressed in HEK293 cells by ELISA


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430862
PNG
(CHEMBL2336040)
Show SMILES COc1cccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C23H18N4O2/c1-16-6-8-19(23(28)26-20-4-3-5-21(13-20)29-2)12-18(16)9-7-17-14-24-22-10-11-25-27(22)15-17/h3-6,8,10-15H,1-2H3,(H,26,28)
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n/an/a 4n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM13216
PNG
(BMS-354825 | CHEMBL1421 | DASATINIB | N-(2-Chloro-...)
Show SMILES Cc1nc(Nc2ncc(s2)C(=O)Nc2c(C)cccc2Cl)cc(n1)N1CCN(CCO)CC1
Show InChI InChI=1S/C22H26ClN7O2S/c1-14-4-3-5-16(23)20(14)28-21(32)17-13-24-22(33-17)27-18-12-19(26-15(2)25-18)30-8-6-29(7-9-30)10-11-31/h3-5,12-13,31H,6-11H2,1-2H3,(H,28,32)(H,24,25,26,27)
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n/an/a 4.80n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM185589
PNG
(US9156852, 83)
Show SMILES CC(=O)c1ccc(Nc2nccc3c(NC(=O)c4csc5c(N)ncnc45)c(C)ccc23)cc1
Show InChI InChI=1S/C25H20N6O2S/c1-13-3-8-18-17(9-10-27-24(18)30-16-6-4-15(5-7-16)14(2)32)20(13)31-25(33)19-11-34-22-21(19)28-12-29-23(22)26/h3-12H,1-2H3,(H,27,30)(H,31,33)(H2,26,28,29)
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US Patent
n/an/a 5n/an/an/an/an/an/a



HANMI PHARM. CO., LTD

US Patent


Assay Description
The compounds prepared in Examples were tested for inhibitory activity against FMS, DDR1 and DDR2 kinases using Kinase Screening and Profiling Servic...


US Patent US9156852 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50112618
PNG
(CHEMBL3608787)
Show SMILES C[C@H](NC(=O)Nc1ccccc1)c1ccc(C)c(NC(=O)c2cnc3ccccn23)c1
Show InChI InChI=1/C24H23N5O2/c1-16-11-12-18(17(2)26-24(31)27-19-8-4-3-5-9-19)14-20(16)28-23(30)21-15-25-22-10-6-7-13-29(21)22/h3-15,17H,1-2H3,(H,28,30)(H2,26,27,31)/t17-/s2
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n/an/a 6n/an/an/an/an/an/a



Astex Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) after 1 hr by time resolved fluorescence method


ACS Med Chem Lett 6: 798-803 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430868
PNG
(CHEMBL2331602)
Show SMILES Cc1cccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C23H18N4O/c1-16-4-3-5-21(12-16)26-23(28)20-8-6-17(2)19(13-20)9-7-18-14-24-22-10-11-25-27(22)15-18/h3-6,8,10-15H,1-2H3,(H,26,28)
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n/an/a 6n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430857
PNG
(CHEMBL2336021)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C23H15F3N4O/c1-15-5-7-18(22(31)29-20-4-2-3-19(12-20)23(24,25)26)11-17(15)8-6-16-13-27-21-9-10-28-30(21)14-16/h2-5,7,9-14H,1H3,(H,29,31)
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n/an/a 6.10n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430850
PNG
(CHEMBL2336006)
Show SMILES Cc1cc(C)cc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C24H20N4O/c1-16-10-17(2)12-22(11-16)27-24(29)21-6-4-18(3)20(13-21)7-5-19-14-25-23-8-9-26-28(23)15-19/h4,6,8-15H,1-3H3,(H,27,29)
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n/an/a 6.30n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430847
PNG
(CHEMBL2336009)
Show SMILES CN1CCN(Cc2cc(C)cc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4ccnn4c3)c2)CC1
Show InChI InChI=1S/C29H30N6O/c1-21-14-24(19-34-12-10-33(3)11-13-34)16-27(15-21)32-29(36)26-6-4-22(2)25(17-26)7-5-23-18-30-28-8-9-31-35(28)20-23/h4,6,8-9,14-18,20H,10-13,19H2,1-3H3,(H,32,36)
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n/an/a 6.70n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430839
PNG
(CHEMBL2336015)
Show SMILES CCc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cc(CN2CCN(C)CC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C30H29F3N6O/c1-3-23-6-7-25(16-24(23)5-4-21-18-34-28-8-9-35-39(28)20-21)29(40)36-27-15-22(14-26(17-27)30(31,32)33)19-38-12-10-37(2)11-13-38/h6-9,14-18,20H,3,10-13,19H2,1-2H3,(H,36,40)
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n/an/a 6.80n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430840
PNG
(CHEMBL2336017)
Show SMILES CN1CCN(Cc2cc(NC(=O)c3cccc(c3)C#Cc3cnc4ccnn4c3)cc(c2)C(F)(F)F)CC1
Show InChI InChI=1S/C28H25F3N6O/c1-35-9-11-36(12-10-35)18-22-14-24(28(29,30)31)16-25(15-22)34-27(38)23-4-2-3-20(13-23)5-6-21-17-32-26-7-8-33-37(26)19-21/h2-4,7-8,13-17,19H,9-12,18H2,1H3,(H,34,38)
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n/an/a 7n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430848
PNG
(CHEMBL2336008)
Show SMILES CN1CCN(Cc2cc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4ccnn4c3)cc(c2)C(F)(F)F)CC1
Show InChI InChI=1S/C29H27F3N6O/c1-20-3-5-24(15-23(20)6-4-21-17-33-27-7-8-34-38(27)19-21)28(39)35-26-14-22(13-25(16-26)29(30,31)32)18-37-11-9-36(2)10-12-37/h3,5,7-8,13-17,19H,9-12,18H2,1-2H3,(H,35,39)
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n/an/a 8.90n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM104010
PNG
(DDR1-IN-2)
Show SMILES CCN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(NCc3cnc4[nH]ccc4c3OC)c2)CC1
Show InChI InChI=1S/C31H35F3N6O2/c1-4-39-11-13-40(14-12-39)19-22-7-6-21(15-26(22)31(32,33)34)30(41)38-24-8-5-20(2)27(16-24)36-17-23-18-37-29-25(9-10-35-29)28(23)42-3/h5-10,15-16,18,36H,4,11-14,17,19H2,1-3H3,(H,35,37)(H,38,41)
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n/an/a 9n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human DDR1 in doxycycline-stimulated human U2OS cells assessed as inhibition of collagen-1-induced autophosphorylation incubated for 1 ...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430854
PNG
(CHEMBL2336024)
Show SMILES CN(C)c1cccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C24H21N5O/c1-17-7-9-20(24(30)27-21-5-4-6-22(14-21)28(2)3)13-19(17)10-8-18-15-25-23-11-12-26-29(23)16-18/h4-7,9,11-16H,1-3H3,(H,27,30)
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n/an/a 9.70n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430841
PNG
(CHEMBL2336016)
Show SMILES CN1CCN(Cc2cc(NC(=O)c3ccc(Cl)c(c3)C#Cc3cnc4ccnn4c3)cc(c2)C(F)(F)F)CC1
Show InChI InChI=1S/C28H24ClF3N6O/c1-36-8-10-37(11-9-36)17-20-12-23(28(30,31)32)15-24(13-20)35-27(39)22-4-5-25(29)21(14-22)3-2-19-16-33-26-6-7-34-38(26)18-19/h4-7,12-16,18H,8-11,17H2,1H3,(H,35,39)
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n/an/a 10n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430842
PNG
(CHEMBL2336014)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cc(CN2CCCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H24F3N5O/c1-19-4-6-23(14-22(19)7-5-20-16-32-26-8-9-33-36(26)18-20)27(37)34-25-13-21(17-35-10-2-3-11-35)12-24(15-25)28(29,30)31/h4,6,8-9,12-16,18H,2-3,10-11,17H2,1H3,(H,34,37)
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n/an/a 12n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430845
PNG
(CHEMBL2336011)
Show SMILES COc1cc(CN2CCN(C)CC2)cc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C29H30N6O2/c1-21-4-6-25(16-24(21)7-5-22-18-30-28-8-9-31-35(28)20-22)29(36)32-26-14-23(15-27(17-26)37-3)19-34-12-10-33(2)11-13-34/h4,6,8-9,14-18,20H,10-13,19H2,1-3H3,(H,32,36)
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n/an/a 13n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430846
PNG
(CHEMBL2336010)
Show SMILES CN1CCN(Cc2cc(Cl)cc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4ccnn4c3)c2)CC1
Show InChI InChI=1S/C28H27ClN6O/c1-20-3-5-24(15-23(20)6-4-21-17-30-27-7-8-31-35(27)19-21)28(36)32-26-14-22(13-25(29)16-26)18-34-11-9-33(2)10-12-34/h3,5,7-8,13-17,19H,9-12,18H2,1-2H3,(H,32,36)
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n/an/a 14n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430860
PNG
(CHEMBL2336019)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cccc(Br)c1
Show InChI InChI=1S/C22H15BrN4O/c1-15-5-7-18(22(28)26-20-4-2-3-19(23)12-20)11-17(15)8-6-16-13-24-21-9-10-25-27(21)14-16/h2-5,7,9-14H,1H3,(H,26,28)
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n/an/a 17n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430844
PNG
(CHEMBL2336012)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cc(CN2CCOCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H24F3N5O2/c1-19-2-4-23(14-22(19)5-3-20-16-32-26-6-7-33-36(26)18-20)27(37)34-25-13-21(12-24(15-25)28(29,30)31)17-35-8-10-38-11-9-35/h2,4,6-7,12-16,18H,8-11,17H2,1H3,(H,34,37)
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n/an/a 17n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430853
PNG
(CHEMBL2336025)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cccc(c1)-n1ccnc1
Show InChI InChI=1S/C25H18N6O/c1-18-5-7-21(13-20(18)8-6-19-15-27-24-9-10-28-31(24)16-19)25(32)29-22-3-2-4-23(14-22)30-12-11-26-17-30/h2-5,7,9-17H,1H3,(H,29,32)
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n/an/a 19n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430859
PNG
(CHEMBL2336020)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cccc(I)c1
Show InChI InChI=1S/C22H15IN4O/c1-15-5-7-18(22(28)26-20-4-2-3-19(23)12-20)11-17(15)8-6-16-13-24-21-9-10-25-27(21)14-16/h2-5,7,9-14H,1H3,(H,26,28)
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n/an/a 20n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430861
PNG
(CHEMBL2336018)
Show SMILES COc1ccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)cc1
Show InChI InChI=1S/C23H18N4O2/c1-16-3-5-19(23(28)26-20-7-9-21(29-2)10-8-20)13-18(16)6-4-17-14-24-22-11-12-25-27(22)15-17/h3,5,7-15H,1-2H3,(H,26,28)
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n/an/a 22n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM185591
PNG
(US9156852, 116)
Show SMILES Cc1ccc2c(Nc3cccc(Cl)c3F)nccc2c1NC(=O)c1csc2c(N)ncnc12
Show InChI InChI=1S/C23H16ClFN6OS/c1-11-5-6-13-12(7-8-27-22(13)30-16-4-2-3-15(24)17(16)25)18(11)31-23(32)14-9-33-20-19(14)28-10-29-21(20)26/h2-10H,1H3,(H,27,30)(H,31,32)(H2,26,28,29)
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US Patent
n/an/a 23n/an/an/an/an/an/a



HANMI PHARM. CO., LTD

US Patent


Assay Description
The compounds prepared in Examples were tested for inhibitory activity against FMS, DDR1 and DDR2 kinases using Kinase Screening and Profiling Servic...


US Patent US9156852 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430872
PNG
(CHEMBL2336031)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)NC1CCCCC1
Show InChI InChI=1S/C22H22N4O/c1-16-7-9-19(22(27)25-20-5-3-2-4-6-20)13-18(16)10-8-17-14-23-21-11-12-24-26(21)15-17/h7,9,11-15,20H,2-6H2,1H3,(H,25,27)
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n/an/a 29n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430849
PNG
(CHEMBL2336007)
Show SMILES Cc1cc(Cl)cc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C23H17ClN4O/c1-15-9-20(24)12-21(10-15)27-23(29)19-5-3-16(2)18(11-19)6-4-17-13-25-22-7-8-26-28(22)14-17/h3,5,7-14H,1-2H3,(H,27,29)
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n/an/a 30n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50237710
PNG
(4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifl...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)
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n/an/a 33n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430855
PNG
(CHEMBL2336023)
Show SMILES CC(C)Oc1cccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)c1
Show InChI InChI=1S/C25H22N4O2/c1-17(2)31-23-6-4-5-22(14-23)28-25(30)21-9-7-18(3)20(13-21)10-8-19-15-26-24-11-12-27-29(24)16-19/h4-7,9,11-17H,1-3H3,(H,28,30)
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n/an/a 35n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430843
PNG
(CHEMBL2336013)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1cc(CN2CCCCC2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C29H26F3N5O/c1-20-5-7-24(15-23(20)8-6-21-17-33-27-9-10-34-37(27)19-21)28(38)35-26-14-22(13-25(16-26)29(30,31)32)18-36-11-3-2-4-12-36/h5,7,9-10,13-17,19H,2-4,11-12,18H2,1H3,(H,35,38)
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n/an/a 38n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50437152
PNG
(CHEMBL2403816)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2ccc(Nc3ncnc4ccccc34)cc2)n(n1)-c1cccc(N)c1
Show InChI InChI=1S/C28H28N8O/c1-28(2,3)24-16-25(36(35-24)21-8-6-7-18(29)15-21)34-27(37)33-20-13-11-19(12-14-20)32-26-22-9-4-5-10-23(22)30-17-31-26/h4-17H,29H2,1-3H3,(H,30,31,32)(H2,33,34,37)
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n/an/a 39n/an/an/an/an/an/a



Technical University of Dortmund

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) after 120 mins by radiometric assay in presence of gamma-[33P]-ATP


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430870
PNG
(CHEMBL2336033)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)Nc1ccccc1
Show InChI InChI=1S/C22H16N4O/c1-16-7-9-19(22(27)25-20-5-3-2-4-6-20)13-18(16)10-8-17-14-23-21-11-12-24-26(21)15-17/h2-7,9,11-15H,1H3,(H,25,27)
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n/an/a 39n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430858
PNG
(CHEMBL2336028)
Show SMILES CC(C)NC(=O)c1ccc(C)c(c1)C#Cc1cnc2ccnn2c1
Show InChI InChI=1S/C19H18N4O/c1-13(2)22-19(24)17-6-4-14(3)16(10-17)7-5-15-11-20-18-8-9-21-23(18)12-15/h4,6,8-13H,1-3H3,(H,22,24)
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n/an/a 40n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430871
PNG
(CHEMBL2336032)
Show SMILES Cc1ccc(cc1C#Cc1cnc2ccnn2c1)C(=O)NC1CCCC1
Show InChI InChI=1S/C21H20N4O/c1-15-6-8-18(21(26)24-19-4-2-3-5-19)12-17(15)9-7-16-13-22-20-10-11-23-25(20)14-16/h6,8,10-14,19H,2-5H2,1H3,(H,24,26)
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n/an/a 40n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM185586
PNG
(US9156852, 38)
Show SMILES Cc1ccc2c(Nc3cccc(Cl)c3)nccc2c1NC(=O)c1csc2c(N)ncnc12
Show InChI InChI=1S/C23H17ClN6OS/c1-12-5-6-16-15(7-8-26-22(16)29-14-4-2-3-13(24)9-14)18(12)30-23(31)17-10-32-20-19(17)27-11-28-21(20)25/h2-11H,1H3,(H,26,29)(H,30,31)(H2,25,27,28)
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US Patent
n/an/a 40n/an/an/an/an/an/a



HANMI PHARM. CO., LTD

US Patent


Assay Description
The compounds prepared in Examples were tested for inhibitory activity against FMS, DDR1 and DDR2 kinases using Kinase Screening and Profiling Servic...


US Patent US9156852 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM13530
PNG
(4-[(4-methylpiperazin-1-yl)methyl]-N-[4-methyl-3-[...)
Show SMILES CN1CCN(Cc2ccc(cc2)C(=O)Nc2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)CC1
Show InChI InChI=1S/C29H31N7O/c1-21-5-10-25(18-27(21)34-29-31-13-11-26(33-29)24-4-3-12-30-19-24)32-28(37)23-8-6-22(7-9-23)20-36-16-14-35(2)15-17-36/h3-13,18-19H,14-17,20H2,1-2H3,(H,32,37)(H,31,33,34)
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n/an/a 43n/an/an/an/an/an/a



Novartis Institutes for BioMedical Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of DDR1 expressed in HEK293 cells by ELISA


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50080408
PNG
(CHEMBL3422021)
Show SMILES CCS(=O)(=O)c1ccc(Cl)cc1Cn1c(=O)[nH]c2c(Cl)c(CN3CCNCC3)c(cc2c1=O)C(F)(F)F
Show InChI InChI=1S/C23H23Cl2F3N4O4S/c1-2-37(35,36)18-4-3-14(24)9-13(18)11-32-21(33)15-10-17(23(26,27)28)16(12-31-7-5-29-6-8-31)19(25)20(15)30-22(32)34/h3-4,9-10,29H,2,5-8,11-12H2,1H3,(H,30,34)
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n/an/a 43n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin)


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50237710
PNG
(4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifl...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)
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n/an/a 43n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1b (unknown origin) assessed as reduction in collagen-induced DDR1b activation


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50237710
PNG
(4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifl...)
Show SMILES Cc1cn(cn1)-c1cc(NC(=O)c2ccc(C)c(Nc3nccc(n3)-c3cccnc3)c2)cc(c1)C(F)(F)F
Show InChI InChI=1S/C28H22F3N7O/c1-17-5-6-19(10-25(17)37-27-33-9-7-24(36-27)20-4-3-8-32-14-20)26(39)35-22-11-21(28(29,30)31)12-23(13-22)38-15-18(2)34-16-38/h3-16H,1-2H3,(H,35,39)(H,33,36,37)
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n/an/a 43n/an/an/an/an/an/a



Massachusetts General Hospital and Harvard Medical School



Assay Description
Tet inducible human DDR1 over-expressing U2OS was pre-treated by media containing each of the compound for 1 hour and treated by changing the media t...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM104010
PNG
(DDR1-IN-2)
Show SMILES CCN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(NCc3cnc4[nH]ccc4c3OC)c2)CC1
Show InChI InChI=1S/C31H35F3N6O2/c1-4-39-11-13-40(14-12-39)19-22-7-6-21(15-26(22)31(32,33)34)30(41)38-24-8-5-20(2)27(16-24)36-17-23-18-37-29-25(9-10-35-29)28(23)42-3/h5-10,15-16,18,36H,4,11-14,17,19H2,1-3H3,(H,35,37)(H,38,41)
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n/an/a 47n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human DDR1 kinase domain (601 to 913 residues) expressed in Sf9 cells by enzymatic kinase assay


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM104010
PNG
(DDR1-IN-2)
Show SMILES CCN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(NCc3cnc4[nH]ccc4c3OC)c2)CC1
Show InChI InChI=1S/C31H35F3N6O2/c1-4-39-11-13-40(14-12-39)19-22-7-6-21(15-26(22)31(32,33)34)30(41)38-24-8-5-20(2)27(16-24)36-17-23-18-37-29-25(9-10-35-29)28(23)42-3/h5-10,15-16,18,36H,4,11-14,17,19H2,1-3H3,(H,35,37)(H,38,41)
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n/an/a 47.6n/an/an/an/an/an/a



Massachusetts General Hospital and Harvard Medical School



Assay Description
Tet inducible human DDR1 over-expressing U2OS was pre-treated by media containing each of the compound for 1 hour and treated by changing the media t...


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More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430867
PNG
(CHEMBL2336035)
Show SMILES Cc1ccc(NC(=O)c2ccc(C)c(c2)C#Cc2cnc3ccnn3c2)cc1
Show InChI InChI=1S/C23H18N4O/c1-16-3-9-21(10-4-16)26-23(28)20-7-5-17(2)19(13-20)8-6-18-14-24-22-11-12-25-27(22)15-18/h3-5,7,9-15H,1-2H3,(H,26,28)
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n/an/a 48n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


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More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50430874
PNG
(CHEMBL2336029)
Show SMILES CCCCNC(=O)c1ccc(C)c(c1)C#Cc1cnc2ccnn2c1
Show InChI InChI=1S/C20H20N4O/c1-3-4-10-21-20(25)18-7-5-15(2)17(12-18)8-6-16-13-22-19-9-11-23-24(19)14-16/h5,7,9,11-14H,3-4,10H2,1-2H3,(H,21,25)
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n/an/a 65n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) using fluorescein-labeled poly GAT as substrate incubated for 1 hr prior to substrate addition measured after 1 h...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50362099
PNG
(CHEMBL1738943 | Thiazole-urea, 9)
Show SMILES Cc1ccc(cc1)-n1nc(cc1NC(=O)Nc1nc(CCOCc2ccncc2)cs1)C(C)(C)C
Show InChI InChI=1S/C26H30N6O2S/c1-18-5-7-21(8-6-18)32-23(15-22(31-32)26(2,3)4)29-24(33)30-25-28-20(17-35-25)11-14-34-16-19-9-12-27-13-10-19/h5-10,12-13,15,17H,11,14,16H2,1-4H3,(H2,28,29,30,33)
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n/an/a 68n/an/an/an/an/an/a



Technical University of Dortmund

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin) after 120 mins by radiometric assay in presence of gamma-[33P]-ATP


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM185590
PNG
(US9156852, 105)
Show SMILES Cc1ccc2c(Nc3ccc(F)c(Cl)c3)nccc2c1NC(=O)c1csc2c(N)ncnc12
Show InChI InChI=1S/C23H16ClFN6OS/c1-11-2-4-14-13(6-7-27-22(14)30-12-3-5-17(25)16(24)8-12)18(11)31-23(32)15-9-33-20-19(15)28-10-29-21(20)26/h2-10H,1H3,(H,27,30)(H,31,32)(H2,26,28,29)
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US Patent
n/an/a 71n/an/an/an/an/an/a



HANMI PHARM. CO., LTD

US Patent


Assay Description
The compounds prepared in Examples were tested for inhibitory activity against FMS, DDR1 and DDR2 kinases using Kinase Screening and Profiling Servic...


US Patent US9156852 (2015)

More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM104009
PNG
(DDR1-IN-1)
Show SMILES CCN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(Oc3ccc4NC(=O)Cc4c3)c2)CC1
Show InChI InChI=1S/C30H31F3N4O3/c1-3-36-10-12-37(13-11-36)18-21-6-5-20(15-25(21)30(31,32)33)29(39)34-23-7-4-19(2)27(17-23)40-24-8-9-26-22(14-24)16-28(38)35-26/h4-9,14-15,17H,3,10-13,16,18H2,1-2H3,(H,34,39)(H,35,38)
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n/an/a 86n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human DDR1 in doxycycline-stimulated human U2OS cells assessed as inhibition of collagen-1-induced autophosphorylation incubated for 1 ...


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More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM50080409
PNG
(CHEMBL3422020)
Show SMILES CCS(=O)(=O)c1ccc(Cl)cc1CNC(=O)c1ccc(CN2CCN(C)CC2)c(c1)C(F)(F)F
Show InChI InChI=1S/C23H27ClF3N3O3S/c1-3-34(32,33)21-7-6-19(24)12-18(21)14-28-22(31)16-4-5-17(20(13-16)23(25,26)27)15-30-10-8-29(2)9-11-30/h4-7,12-13H,3,8-11,14-15H2,1-2H3,(H,28,31)
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n/an/a 97n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of DDR1 (unknown origin)


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine Kinase DDR1


(Homo sapiens)
BDBM104009
PNG
(DDR1-IN-1)
Show SMILES CCN1CCN(Cc2ccc(cc2C(F)(F)F)C(=O)Nc2ccc(C)c(Oc3ccc4NC(=O)Cc4c3)c2)CC1
Show InChI InChI=1S/C30H31F3N4O3/c1-3-36-10-12-37(13-11-36)18-21-6-5-20(15-25(21)30(31,32)33)29(39)34-23-7-4-19(2)27(17-23)40-24-8-9-26-22(14-24)16-28(38)35-26/h4-9,14-15,17H,3,10-13,16,18H2,1-2H3,(H,34,39)(H,35,38)
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n/an/a 105n/an/an/an/an/an/a



Chinese Academy of Sciences

Curated by ChEMBL


Assay Description
Inhibition of human DDR1 kinase domain (601 to 913 residues) expressed in Sf9 cells by enzymatic kinase assay


Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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