Detailed information for compound 433511

Basic information

Technical information
  • TDR Targets ID: 433511
  • Name: 4-[[2-[4-chloro-3-(2-diethylaminoethyloxy)ani lino]-1,3-benzoxazol-5-yl]oxy]-N-methylpyridi ne-2-carboxamide
  • MW: 509.985 | Formula: C26H28ClN5O4
  • H donors: 2 H acceptors: 3 LogP: 5.08 Rotable bonds: 12
    Rule of 5 violations (Lipinski): 2
  • SMILES: CCN(CCOc1cc(ccc1Cl)Nc1nc2c(o1)ccc(c2)Oc1ccnc(c1)C(=O)NC)CC
  • InChi: 1S/C26H28ClN5O4/c1-4-32(5-2)12-13-34-24-14-17(6-8-20(24)27)30-26-31-21-15-18(7-9-23(21)36-26)35-19-10-11-29-22(16-19)25(33)28-3/h6-11,14-16H,4-5,12-13H2,1-3H3,(H,28,33)(H,30,31)
  • InChiKey: PPIHIEHMPATSBJ-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 4-[[2-[4-chloro-3-(2-diethylaminoethyloxy)anilino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-pyridine-2-carboxamide
  • 4-[[2-[4-chloro-3-(2-diethylaminoethyloxy)anilino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-2-pyridinecarboxamide
  • 4-[[2-[[4-chloro-3-(2-diethylaminoethyloxy)phenyl]amino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-pyridine-2-carboxamide
  • 4-[[2-[4-chloro-3-(2-diethylaminoethyloxy)anilino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-picolinamide
  • 4-[[2-[[4-chloro-3-(2-diethylaminoethoxy)phenyl]amino]-1,3-benzoxazol-5-yl]oxy]-N-methylpyridine-2-carboxamide
  • 4-[[2-[[4-chloro-3-(2-diethylaminoethoxy)phenyl]amino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-pyridine-2-carboxamide
  • 4-[[2-[[4-chloro-3-(2-diethylaminoethoxy)phenyl]amino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-2-pyridinecarboxamide
  • 4-[[2-[[4-chloro-3-(2-diethylaminoethoxy)phenyl]amino]-1,3-benzoxazol-5-yl]oxy]-N-methyl-picolinamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens kinase insert domain receptor Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Loa Loa (eye worm) TK/KIN16 protein kinase Get druggable targets OG5_130320 All targets in OG5_130320
Onchocerca volvulus Tyrosine kinase homolog Get druggable targets OG5_130320 All targets in OG5_130320
Brugia malayi Immunoglobulin I-set domain containing protein Get druggable targets OG5_130320 All targets in OG5_130320
Onchocerca volvulus Get druggable targets OG5_130320 All targets in OG5_130320
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Toxoplasma gondii phosphorylase family protein 0.019 0.194 1
Giardia lamblia 5-methylthioadenosine nucleosidase, S-adenosylhomocysteine nucleosidase 0.019 0.194 0.1691
Trichomonas vaginalis conserved hypothetical protein 0.019 0.194 0.1691
Mycobacterium ulcerans purine nucleoside phosphorylase 0.0917 1 1
Echinococcus multilocularis peptidase Clp (S14 family) 0.0058 0.0481 0.045
Toxoplasma gondii hypoxanthine-xanthine-guanine phosphoribosyl transferase HXGPRT 0.0179 0.1821 0.9326
Mycobacterium leprae PROBABLE OROTATE PHOSPHORIBOSYLTRANSFERASE PYRE (OPRT) (OPRTASE) 0.0042 0.03 0.0128
Schistosoma mansoni uracil phosphoribosyltransferase 0.0042 0.03 0.03
Toxoplasma gondii Purine nucleoside phosphorylase 0.019 0.194 1
Echinococcus multilocularis methylthioadenosine phosphorylase 0.019 0.194 0.1914
Giardia lamblia Guanine phosphoribosyltransferase 0.0179 0.1821 0.1568
Mycobacterium leprae Probable hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (IMP pho 0.0137 0.1356 0.1203
Plasmodium vivax bifunctional dihydrofolate reductase-thymidylate synthase, putative 0.0165 0.1661 0.8422
Loa Loa (eye worm) hypothetical protein 0.0058 0.0479 0.0606
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.019 0.194 0.5
Schistosoma mansoni uridine phosphorylase 0.019 0.194 0.194
Trypanosoma cruzi nucleoside phosphorylase, putative 0.019 0.194 1
Loa Loa (eye worm) transcription factor SMAD2 0.0139 0.1376 0.1743
Chlamydia trachomatis AMP nucleosidase 0.019 0.194 1
Schistosoma mansoni dihydrofolate reductase 0.0048 0.0364 0.0364
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.019 0.194 0.5
Treponema pallidum ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.3657
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase 0.0165 0.1661 0.8302
Echinococcus granulosus peptidase Clp S14 family 0.0058 0.0481 0.0481
Plasmodium falciparum ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.3657
Giardia lamblia 5-methylthioadenosine nucleosidase, S-adenosylhomocysteine nucleosidase 0.019 0.194 0.1691
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Brugia malayi thymidylate synthase 0.0117 0.1132 0.1098
Echinococcus multilocularis GPCR, family 2 0.0018 0.0039 0.0007
Trypanosoma cruzi nucleoside phosphorylase, putative 0.019 0.194 1
Mycobacterium tuberculosis Conserved hypothetical protein 0.019 0.194 0.1691
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0018 0.0039 0.0007
Loa Loa (eye worm) hypothetical protein 0.0018 0.0032 0.004
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.1821
Treponema pallidum phosphoribosylpyrophosphate synthetase 0.0042 0.03 0.0711
Trichomonas vaginalis purine nucleoside phosphorylase I, putative 0.0917 1 1
Schistosoma mansoni hypothetical protein 0.0018 0.0039 0.0039
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Echinococcus granulosus inosine guanosine and xanthosine phosphorylase 0.0727 0.7895 0.7895
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP) 0.0058 0.0481 0.0186
Mycobacterium tuberculosis Probable purine nucleoside phosphorylase DeoD (inosine phosphorylase) (PNP) 0.0917 1 1
Plasmodium falciparum bifunctional dihydrofolate reductase-thymidylate synthase 0.0165 0.1661 0.8422
Giardia lamblia Purine nucleoside phosphorylase lateral transfer candidate 0.0917 1 1
Brugia malayi MTAP 0.019 0.194 0.1909
Plasmodium falciparum purine nucleoside phosphorylase 0.019 0.194 1
Echinococcus multilocularis purine nucleoside phosphorylase 0.0727 0.7895 0.7888
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.2894
Onchocerca volvulus 0.0167 0.1682 0.1425
Schistosoma mansoni orotidine 5'-phosphate decarboxylase 0.0042 0.03 0.03
Toxoplasma gondii phosphorylase family protein 0.019 0.194 1
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9275
Mycobacterium tuberculosis Probable bifunctional MTA/SAH nucleosidase Mtn: 5'-methylthioadenosine nucleosidase (methylthioadenosine methylthioribohydrolase 0.019 0.194 0.1691
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.019 0.194 0.5
Schistosoma mansoni bifunctional dihydrofolate reductase-thymidylate synthase 0.0117 0.1132 0.1132
Onchocerca volvulus 0.0117 0.1132 0.0858
Trypanosoma cruzi nucleoside phosphorylase, putative 0.019 0.194 1
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Schistosoma mansoni hypothetical protein 0.0018 0.0039 0.0039
Schistosoma mansoni hypothetical protein 0.0018 0.0039 0.0039
Trichomonas vaginalis conserved hypothetical protein 0.019 0.194 0.1691
Echinococcus multilocularis uridine 5' monophosphate synthase 0.0042 0.03 0.0269
Treponema pallidum adenine phosphoribosyltransferase 0.0042 0.03 0.0711
Mycobacterium ulcerans 5'-methylthioadenosine phosphorylase 0.019 0.194 0.1691
Chlamydia trachomatis ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.2894
Loa Loa (eye worm) S-methyl-5'-thioadenosine phosphorylase MTAP 0.019 0.194 0.2457
Onchocerca volvulus Tyrosine kinase homolog 0.0171 0.1725 0.1469
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9275
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Brugia malayi Immunoglobulin I-set domain containing protein 0.0183 0.1858 0.1827
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase 0.0179 0.1821 0.1821
Trichomonas vaginalis hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.1568
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Echinococcus multilocularis thymidylate synthase 0.0117 0.1132 0.1104
Wolbachia endosymbiont of Brugia malayi ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 1
Mycobacterium ulcerans hypoxanthine-guanine phosphoribosyltransferase Hpt 0.0179 0.1821 0.1568
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9275
Mycobacterium ulcerans bifunctional Mta/Sah nucleosidase Mtn 0.019 0.194 0.1691
Echinococcus multilocularis purine nucleoside phosphorylase 0.0727 0.7895 0.7888
Leishmania major nucleoside phosphorylase-like protein 0.019 0.194 1
Brugia malayi Probable ClpP-like protease 0.0089 0.082 0.0784
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0042 0.03 0.03
Loa Loa (eye worm) thymidylate synthase 0.0117 0.1132 0.1434
Loa Loa (eye worm) hypothetical protein 0.0018 0.0039 0.0049
Brugia malayi hypothetical protein 0.0056 0.0452 0.0415
Leishmania major methylthioadenosine phosphorylase, putative 0.019 0.194 1
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0018 0.0039 0.0039
Mycobacterium tuberculosis Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2) 0.0058 0.0481 0.0186
Schistosoma mansoni methylthioadenosine phosphorylase 0.019 0.194 0.194
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0058 0.0479 0.0442
Brugia malayi Dihydrofolate reductase 0.0048 0.0364 0.0327
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0089 0.082 0.3657
Echinococcus granulosus thymidylate synthase 0.0117 0.1132 0.1132
Schistosoma mansoni methylthioadenosine phosphorylase 0.019 0.194 0.194
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0018 0.0039 0.0007
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.9275
Loa Loa (eye worm) dihydrofolate reductase 0.0048 0.0364 0.0461
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.1821
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.0536
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.019 0.194 0.5
Toxoplasma gondii orotate phosphoribosyltransferase 0.0042 0.03 0.0711
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2) 0.0089 0.082 0.0657
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Mycobacterium ulcerans dihydrofolate reductase DfrA 0.0048 0.0364 0.0066
Echinococcus granulosus uridine phosphorylase 1 0.019 0.194 0.194
Echinococcus granulosus uridine 5' monophosphate synthase 0.0042 0.03 0.03
Brugia malayi MH2 domain containing protein 0.0139 0.1376 0.1343
Schistosoma mansoni purine nucleoside phosphorylase 0.0917 1 1
Echinococcus granulosus adenine phosphoribosyltransferase 0.0042 0.03 0.03
Mycobacterium ulcerans thymidylate synthase 0.0117 0.1132 0.0858
Mycobacterium tuberculosis Probable thymidylate synthase ThyA (ts) (TSASE) 0.0117 0.1132 0.0858
Plasmodium vivax orotate phosphoribosyltransferase, putative 0.0042 0.03 0.0711
Schistosoma mansoni peptidase Clp (S14 family) 0.0089 0.082 0.082
Plasmodium vivax ATP-dependent Clp protease proteolytic subunit, putative 0.0089 0.082 0.3657
Leishmania major xanthine phosphoribosyltransferase 0.0179 0.1821 0.9275
Giardia lamblia UPL-1 0.019 0.194 0.1691
Mycobacterium tuberculosis Hypothetical protein 0.0056 0.0452 0.0157
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Loa Loa (eye worm) hypothetical protein 0.0089 0.082 0.1039
Echinococcus granulosus methylthioadenosine phosphorylase 0.019 0.194 0.194
Trichomonas vaginalis conserved hypothetical protein 0.0056 0.0452 0.0157
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Loa Loa (eye worm) uridine phosphorylase 0.019 0.194 0.2457
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Brugia malayi Adenine phosphoribosyltransferase 0.0042 0.03 0.0262
Echinococcus granulosus hypoxanthine guanine phosphoribosyltransferase 0.0179 0.1821 0.1821
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase 0.0179 0.1821 0.1795
Entamoeba histolytica hypothetical protein 0.019 0.194 0.5
Trypanosoma cruzi dihydrofolate reductase-thymidylate synthase, putative 0.0056 0.0452 0.0928
Mycobacterium leprae Probable purine nucleoside phosphorylase DeoD (INOSINE PHOSPHORYLASE) (PNP) 0.0917 1 1
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Mycobacterium leprae PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP) 0.0058 0.0481 0.0312
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Schistosoma mansoni hypothetical protein 0.004 0.0275 0.0275
Brugia malayi dihydrofolate reductase family protein 0.0048 0.0364 0.0327
Mycobacterium leprae DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) 0.0048 0.0364 0.0193
Mycobacterium tuberculosis Hypoxanthine-guanine phosphoribosyltransferase Hpt (HGPRT) (HGPRTase) (hypoxanthine phosphoribosyltransferase) (imp pyrophosphor 0.0137 0.1356 0.1089
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0058 0.0479 0.0606
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Loa Loa (eye worm) hypothetical protein 0.004 0.0275 0.0348
Entamoeba histolytica MTA/SAH nucleosidase, putative 0.019 0.194 0.5
Treponema pallidum pfs protein (pfs) 0.019 0.194 1
Trypanosoma brucei dihydrofolate reductase-thymidylate synthase 0.0165 0.1661 0.8302
Mycobacterium ulcerans ATP-dependent Clp protease proteolytic subunit 0.0089 0.082 0.0536
Plasmodium vivax purine nucleoside phosphorylase, putative 0.019 0.194 1
Leishmania major hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.9275
Brugia malayi Phosphoribosyl transferase domain containing protein 0.0179 0.1821 0.1789
Onchocerca volvulus 0.0179 0.1821 0.1568
Loa Loa (eye worm) orotate phosphoribosyltransferase 0.0042 0.03 0.038
Entamoeba histolytica purine nucleoside phosphorylase, putative 0.019 0.194 0.5
Toxoplasma gondii bifunctional dihydrofolate reductase-thymidylate synthase 0.0165 0.1661 0.8422
Brugia malayi latrophilin 2 splice variant baaae 0.004 0.0275 0.0237
Mycobacterium leprae probable uridine phosphorylase 0.019 0.194 0.1797
Schistosoma mansoni purine nucleoside phosphorylase 0.0917 1 1
Brugia malayi Calcitonin receptor-like protein seb-1 0.0058 0.0479 0.0442
Trypanosoma brucei uridine phosphorylase 0.019 0.194 1
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Plasmodium falciparum hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.9326
Echinococcus multilocularis purine nucleoside phosphorylase 0.0917 1 1
Brugia malayi uridine phosphorylase family protein 0.019 0.194 0.1909
Echinococcus multilocularis uridine phosphorylase 1 0.019 0.194 0.1914
Trypanosoma brucei methylthioadenosine phosphorylase, putative 0.019 0.194 1
Leishmania major dihydrofolate reductase-thymidylate synthase 0.0165 0.1661 0.8302
Schistosoma mansoni methylthioadenosine phosphorylase 0.019 0.194 0.194
Echinococcus multilocularis dihydrofolate reductase 0.0048 0.0364 0.0333
Schistosoma mansoni hypoxanthine-guanine phosphoribosyltransferase 0.0042 0.03 0.03
Schistosoma mansoni hypothetical protein 0.0018 0.0039 0.0039
Trypanosoma brucei hypoxanthine-guanine phosphoribosyltransferase 0.0179 0.1821 0.9275
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0018 0.0039 0.0039
Echinococcus granulosus GPCR family 2 0.0018 0.0039 0.0039
Schistosoma mansoni Adenine phosphoribosyltransferase 0.0042 0.03 0.03
Plasmodium vivax hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9326
Loa Loa (eye worm) hypothetical protein 0.0018 0.0032 0.004
Loa Loa (eye worm) latrophilin receptor protein 2 0.0018 0.0039 0.0049
Schistosoma mansoni Adenine phosphoribosyltransferase 0.0042 0.03 0.03
Mycobacterium tuberculosis Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) 0.0048 0.0364 0.0066
Toxoplasma gondii ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein 0.0089 0.082 0.3657
Schistosoma mansoni uridine phosphorylase 0.019 0.194 0.194
Echinococcus granulosus purine nucleoside phosphorylase 0.0917 1 1
Treponema pallidum purine nucleoside phosphorylase (deoD) 0.019 0.194 1
Mycobacterium tuberculosis Hypothetical protein 0.019 0.194 0.1691
Echinococcus granulosus ATP dependent Clp protease proteolytic subunit 0.0089 0.082 0.082
Treponema pallidum uridine phosphorylase (udp) 0.019 0.194 1
Mycobacterium leprae AMIDOPHOSPHORIBOSYLTRANSFERASE PURF (GLUTAMINE PHOSPHORIBOSYLPYROPHOSPHATE AMIDOTRANSFERASE) (ATASE) (GPATASE) 0.0042 0.03 0.0128
Brugia malayi orotate phosphoribosyltransferase family protein 0.0042 0.03 0.0262
Echinococcus multilocularis hypoxanthine guanine phosphoribosyltransferase 0.0179 0.1821 0.1795
Onchocerca volvulus Purine nucleoside phosphorylase homolog 0.0917 1 1
Loa Loa (eye worm) TK/KIN16 protein kinase 0.0183 0.1858 0.2354
Plasmodium falciparum orotate phosphoribosyltransferase 0.0042 0.03 0.0711
Loa Loa (eye worm) MH2 domain-containing protein 0.0139 0.1376 0.1743
Echinococcus granulosus dihydrofolate reductase 0.0048 0.0364 0.0364
Echinococcus granulosus roundabout 2 0.0018 0.0032 0.0032
Mycobacterium leprae PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) 0.0117 0.1132 0.0975
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9275
Giardia lamblia Deoxynucleoside kinase 0.0413 0.4415 0.4242
Trypanosoma cruzi hypoxanthine-guanine phosphoribosyltransferase, putative 0.0179 0.1821 0.9275
Echinococcus multilocularis ATP dependent Clp protease proteolytic subunit 0.0089 0.082 0.0791
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.019 0.194 1
Loa Loa (eye worm) hypothetical protein 0.0727 0.7895 1
Echinococcus multilocularis adenine phosphoribosyltransferase 0.0042 0.03 0.0269
Treponema pallidum hypothetical protein 0.0042 0.03 0.0711
Trypanosoma cruzi methylthioadenosine phosphorylase, putative 0.019 0.194 1
Trichomonas vaginalis purine nucleoside phosphorylase, putative 0.019 0.194 0.1691
Loa Loa (eye worm) adenine phosphoribosyltransferase 0.0042 0.03 0.038

Activities

Activity type Activity value Assay description Source Reference
IC50 (functional) = 34 nM Inhibition of VEGF-stimulated HUVEC cell proliferation after 72 hrs ChEMBL. 17696416
IC50 (functional) = 34 nM Inhibition of VEGF-stimulated HUVEC cell proliferation after 72 hrs ChEMBL. 17696416
Ki (functional) = 5 nM Inhibition of KDR phosphorylation ChEMBL. 17696416
Ki (functional) = 5 nM Inhibition of KDR phosphorylation ChEMBL. 17696416

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?
In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.
 
In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

Bibliographic References

1 literature reference was collected for this gene.

If you have references for this compound, please enter them in a user comment (below) or Contact us.