Detailed information for compound 321310

Basic information

Technical information
  • TDR Targets ID: 321310
  • Name: 1-[[5-(5-chlorothiophen-2-yl)-1,2-oxazol-3-yl ]methyl]-N-(1-pyridin-4-ylpiperidin-4-yl)indo le-2-carboxamide
  • MW: 518.03 | Formula: C27H24ClN5O2S
  • H donors: 1 H acceptors: 3 LogP: 5.33 Rotable bonds: 7
    Rule of 5 violations (Lipinski): 2
  • SMILES: Clc1ccc(s1)c1onc(c1)Cn1c(cc2c1cccc2)C(=O)NC1CCN(CC1)c1ccncc1
  • InChi: 1S/C27H24ClN5O2S/c28-26-6-5-25(36-26)24-16-20(31-35-24)17-33-22-4-2-1-3-18(22)15-23(33)27(34)30-19-9-13-32(14-10-19)21-7-11-29-12-8-21/h1-8,11-12,15-16,19H,9-10,13-14,17H2,(H,30,34)
  • InChiKey: VGXIAQUUVIGDPS-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • 1-[[5-(5-chloro-2-thienyl)isoxazol-3-yl]methyl]-N-[1-(4-pyridyl)-4-piperidyl]indole-2-carboxamide
  • 1-[[5-(5-chloro-2-thienyl)-3-isoxazolyl]methyl]-N-[1-(4-pyridyl)-4-piperidinyl]-2-indolecarboxamide

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens kallikrein 1 Starlite/ChEMBL References
Homo sapiens coagulation factor II (thrombin) Starlite/ChEMBL References
Homo sapiens coagulation factor X Starlite/ChEMBL References

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Trypsin family protein kallikrein 1 262 aa 247 aa 22.7 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Echinococcus multilocularis glycogen phosphorylase 0.0112 0.0512 0.0484
Echinococcus granulosus glycogen phosphorylase 0.0112 0.0512 0.0643
Toxoplasma gondii exonuclease III APE 0.0059 0.0182 0.1952
Trypanosoma cruzi thymidine kinase, putative 0.078 0.4628 1
Trichomonas vaginalis thymidine kinase, putative 0.078 0.4628 1
Mycobacterium ulcerans glycogen phosphorylase GlgP 0.0049 0.0118 0.1043
Echinococcus granulosus lamin 0.0055 0.0157 0.0171
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Echinococcus granulosus arachidonate 5 lipoxygenase 0.0056 0.0165 0.0182
Echinococcus multilocularis beta LACTamase domain containing family member 0.0037 0.0045 0.0016
Trypanosoma brucei ingi protein (ORF1) 0.0102 0.0451 0.0886
Schistosoma mansoni hypothetical protein 0.0339 0.1912 0.2507
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0202 0.023
Schistosoma mansoni ap endonuclease 0.0059 0.0182 0.0205
Schistosoma mansoni phosphoglucomutase 0.0091 0.0381 0.0469
Loa Loa (eye worm) hypothetical protein 0.0241 0.1303 1
Trypanosoma brucei ingi protein (ORF1) 0.0102 0.0451 0.0886
Loa Loa (eye worm) glycogen phosphorylase 0.0112 0.0512 0.3925
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0079 0.0306 0.057
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0052 0.014 0.1077
Treponema pallidum ribonuclease H (rnhA) 0.0091 0.0381 0.35
Chlamydia trachomatis thymidylate kinase 0.0151 0.075 1
Trypanosoma brucei thymidylate kinase, putative 0.0151 0.075 0.1539
Leishmania major thymidine kinase, putative 0.078 0.4628 1
Trypanosoma cruzi thymidylate kinase, putative 0.0151 0.075 0.1539
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0079 0.0306 0.057
Echinococcus multilocularis musashi 0.0055 0.0157 0.0129
Trypanosoma brucei inositol-1(or 4)-monophosphatase 1, putative 0.0079 0.0306 0.057
Wolbachia endosymbiont of Brugia malayi ribonuclease HI 0.0091 0.0381 0.35
Echinococcus granulosus inositol monophosphatase 1 0.0079 0.0306 0.0369
Giardia lamblia Deoxynucleoside kinase 0.0414 0.2371 0.4925
Giardia lamblia Thymidine kinase 0.078 0.4628 1
Echinococcus granulosus survival motor neuron protein 1 0.0241 0.1303 0.1697
Onchocerca volvulus 0.0055 0.0157 0.1596
Echinococcus multilocularis thymidine kinase 0.1252 0.7541 0.7534
Echinococcus granulosus geminin 0.0339 0.1912 0.2507
Entamoeba histolytica glycogenphosphorylase, putative 0.0049 0.0118 0.0161
Mycobacterium leprae possible inositol monophosphatase SubH (IMPase) (inositol-1-phosphatase) (I-1-Pase ). 0.0071 0.0255 0.2981
Schistosoma mansoni glycogen phosphorylase 0.0112 0.0512 0.0643
Toxoplasma gondii aldehyde dehydrogenase 0.0062 0.0202 0.2225
Trypanosoma brucei thymidylate kinase, putative 0.0151 0.075 0.1539
Plasmodium falciparum thymidylate kinase 0.0151 0.075 1
Leishmania major ribonuclease H1, putative 0.0091 0.0381 0.0734
Schistosoma mansoni glycogen phosphorylase 0.0112 0.0512 0.0643
Loa Loa (eye worm) hypothetical protein 0.0034 0.0029 0.0219
Echinococcus granulosus aldehyde dehydrogenase mitochondrial 0.0062 0.0202 0.023
Schistosoma mansoni thymidylate kinase 0.0151 0.075 0.096
Brugia malayi beta-lactamase 0.0037 0.0045 0.0343
Loa Loa (eye worm) hypothetical protein 0.0055 0.0157 0.1206
Entamoeba histolytica myo-inositol monophosphatase, putative 0.0079 0.0306 0.057
Loa Loa (eye worm) hypothetical protein 0.0054 0.0151 0.1159
Trypanosoma brucei thymidine kinase 0.078 0.4628 1
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.014 0.0149
Schistosoma mansoni hypothetical protein 0.0049 0.0121 0.0124
Trypanosoma cruzi apurinic/apyrimidinic endonuclease 0.0059 0.0182 0.03
Brugia malayi hypothetical protein 0.0054 0.0151 0.116
Mycobacterium tuberculosis Probable aldehyde dehydrogenase 0.0062 0.0202 0.1288
Onchocerca volvulus Putative thymidylate kinase 0.0151 0.075 1
Loa Loa (eye worm) intermediate filament protein 0.0055 0.0157 0.1206
Trypanosoma brucei unspecified product 0.0102 0.0451 0.0886
Onchocerca volvulus Glycogen phosphorylase homolog 0.0112 0.0512 0.6622
Echinococcus granulosus thymidine kinase 0.1252 0.7541 1
Echinococcus multilocularis thymidylate kinase 0.0151 0.075 0.0723
Schistosoma mansoni phosphoglucomutase 0.0091 0.0381 0.0469
Plasmodium vivax ataxin-2 like protein, putative 0.0054 0.0151 0.1511
Echinococcus multilocularis thymidine kinase 0.1252 0.7541 0.7534
Brugia malayi beta-lactamase family protein 0.0037 0.0045 0.0343
Echinococcus multilocularis inositol monophosphatase 1 0.0079 0.0306 0.0278
Leishmania major hypothetical protein, conserved 0.0054 0.0151 0.0232
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0059 0.0184 0.0304
Echinococcus granulosus DNA apurinic or apyrimidinic site lyase 0.0059 0.0182 0.0205
Echinococcus multilocularis geminin 0.0339 0.1912 0.1889
Treponema pallidum thymidylate kinase (tmk) 0.0151 0.075 1
Plasmodium vivax AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0059 0.0182 0.1952
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0037 0.0045 0.0343
Brugia malayi intermediate filament protein 0.0055 0.0157 0.1206
Brugia malayi hypothetical protein 0.0241 0.1303 1
Trichomonas vaginalis glycogen phosphorylase, putative 0.0112 0.0512 0.1019
Echinococcus multilocularis transfer RNA-Ile 0.1252 0.7541 0.7534
Toxoplasma gondii thymidylate kinase 0.0151 0.075 1
Loa Loa (eye worm) thymidylate kinase 0.0151 0.075 0.5753
Trypanosoma brucei RNA helicase, putative 0.0499 0.2898 0.6226
Echinococcus multilocularis lamin dm0 0.0055 0.0157 0.0129
Trypanosoma brucei PAB1-binding protein , putative 0.0054 0.0151 0.0232
Trypanosoma brucei ribonuclease H1 0.0091 0.0381 0.0734
Mycobacterium ulcerans thymidylate kinase 0.0151 0.075 1
Schistosoma mansoni inositol monophosphatase 0.0079 0.0306 0.0369
Giardia lamblia Ribonuclease H 0.0091 0.0381 0.0447
Onchocerca volvulus 0.0049 0.0121 0.1089
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0202 0.2225
Wolbachia endosymbiont of Brugia malayi thymidylate kinase 0.0151 0.075 1
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0037 0.0044 0.0016
Schistosoma mansoni lamin 0.0055 0.0157 0.0171
Brugia malayi beta-lactamase family protein 0.0037 0.0045 0.0343
Plasmodium falciparum AP endonuclease (DNA-[apurinic or apyrimidinic site] lyase), putative 0.0059 0.0182 0.052
Loa Loa (eye worm) exodeoxyribonuclease III family protein 0.0059 0.0182 0.1399
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Brugia malayi thymidylate kinase 0.0151 0.075 0.5753
Schistosoma mansoni hypothetical protein 0.0138 0.0672 0.0857
Echinococcus granulosus thymidine kinase 0.1252 0.7541 1
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0045 0.0021
Echinococcus multilocularis arachidonate 5 lipoxygenase 0.0056 0.0165 0.0137
Entamoeba histolytica exodeoxyribonuclease III, putative 0.0059 0.0182 0.0301
Entamoeba histolytica glycogen phosphorylase, putative 0.0049 0.0118 0.0161
Echinococcus granulosus Glycosyl transferase family 35 0.0112 0.0512 0.0643
Schistosoma mansoni glycogen phosphorylase 0.0049 0.0118 0.0119
Trypanosoma cruzi ribonuclease H1, putative 0.0091 0.0381 0.0734
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Echinococcus multilocularis Glycosyl transferase, family 35 0.0112 0.0512 0.0484
Echinococcus multilocularis glycogen phosphorylase 0.0112 0.0512 0.0484
Mycobacterium tuberculosis Thymidylate kinase Tmk (dTMP kinase) (thymidylic acid kinase) (TMPK) 0.0151 0.075 0.5789
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.014 0.0112
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0151 0.0232
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.014 0.0149
Schistosoma mansoni hypothetical protein 0.0499 0.2898 0.382
Schistosoma mansoni intermediate filament proteins 0.0055 0.0157 0.0171
Loa Loa (eye worm) intermediate filament tail domain-containing protein 0.0055 0.0157 0.1206
Entamoeba histolytica thymidine kinase, putative 0.078 0.4628 1
Schistosoma mansoni thyroid hormone receptor 0.015 0.0741 0.0948
Brugia malayi Inositol-1 0.0079 0.0306 0.2347
Trichomonas vaginalis inositol monophosphatase, putative 0.0079 0.0306 0.057
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0037 0.0045 0.0343
Brugia malayi Calcitonin receptor-like protein seb-1 0.0108 0.0482 0.37
Echinococcus granulosus intermediate filament protein 0.0055 0.0157 0.0171
Schistosoma mansoni hypothetical protein 0.0074 0.0272 0.0324
Schistosoma mansoni ap endonuclease 0.0059 0.0182 0.0205
Giardia lamblia CDC8 0.0151 0.075 0.1276
Onchocerca volvulus Ribonuclease H1 homolog 0.0091 0.0381 0.4769
Schistosoma mansoni transcription factor LCR-F1 0.0037 0.0044 0.0021
Echinococcus granulosus thymidylate kinase 0.0151 0.075 0.096
Echinococcus granulosus Mitotic checkpoint protein PRCC C terminal 0.0138 0.0672 0.0857
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0037 0.0044 0.0021
Loa Loa (eye worm) hypothetical protein 0.0074 0.0272 0.2089
Toxoplasma gondii ribonuclease HI protein 0.0091 0.0381 0.4769
Brugia malayi Intermediate filament tail domain containing protein 0.0055 0.0157 0.1206
Entamoeba histolytica glycogen phosphorylase, putative 0.0049 0.0118 0.0161
Echinococcus multilocularis Mitotic checkpoint protein PRCC, C terminal 0.0138 0.0672 0.0646
Trichomonas vaginalis ap endonuclease, putative 0.0059 0.0182 0.03
Schistosoma mansoni hypothetical protein 0.0151 0.075 0.096
Mycobacterium ulcerans exodeoxyribonuclease III protein XthA 0.0059 0.0182 0.1952
Brugia malayi RNase H family protein 0.0091 0.0381 0.2923
Schistosoma mansoni hypothetical protein 0.0339 0.1912 0.2507
Leishmania major apurinic/apyrimidinic endonuclease-redox protein 0.0059 0.0182 0.03
Brugia malayi RNase H family protein 0.0091 0.0381 0.2923
Trypanosoma cruzi thymidine kinase, putative 0.078 0.4628 1
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0034 0.0029 0.0219
Trichomonas vaginalis ap endonuclease, putative 0.0059 0.0182 0.03
Loa Loa (eye worm) latrophilin receptor protein 2 0.0034 0.0029 0.0219
Leishmania major aldehyde dehydrogenase, mitochondrial precursor 0.0062 0.0202 0.0342
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.014 0.0149
Leishmania major hypothetical protein, conserved 0.0059 0.0184 0.0304
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0052 0.014 0.0149
Mycobacterium tuberculosis Probable exodeoxyribonuclease III protein XthA (exonuclease III) (EXO III) (AP endonuclease VI) 0.0059 0.0182 0.113
Trypanosoma cruzi thymidylate kinase, putative 0.0151 0.075 0.1539
Entamoeba histolytica glycogen phosphorylase, putative 0.0112 0.0512 0.1019
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0202 0.2225
Brugia malayi exodeoxyribonuclease III family protein 0.0059 0.0182 0.1399
Trichomonas vaginalis myo inositol monophosphatase, putative 0.0079 0.0306 0.057
Entamoeba histolytica Thymidylate kinase, putative 0.0151 0.075 0.1539
Brugia malayi Iron-sulfur cluster assembly accessory protein 0.0049 0.0121 0.0932
Echinococcus multilocularis lamin 0.0055 0.0157 0.0129
Trichomonas vaginalis thymidylate kinase, putative 0.0151 0.075 0.1539
Leishmania major thymidylate kinase-like protein 0.0151 0.075 0.1539
Echinococcus multilocularis aldehyde dehydrogenase, mitochondrial 0.0062 0.0202 0.0173
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Onchocerca volvulus 0.0055 0.0157 0.1596
Giardia lamblia Glycogen phosphorylase 0.0112 0.0512 0.0741
Trichomonas vaginalis thymidine kinase, putative 0.078 0.4628 1
Brugia malayi carbohydrate phosphorylase 0.0112 0.0512 0.3925
Mycobacterium tuberculosis Probable glycogen phosphorylase GlgP 0.0049 0.0118 0.0604
Schistosoma mansoni survival motor neuron protein 0.0049 0.0121 0.0124
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0108 0.0482 0.37
Echinococcus multilocularis thyroid hormone receptor alpha 0.015 0.0741 0.0714
Schistosoma mansoni phosphoglucomutase 0.0091 0.0381 0.0469
Mycobacterium ulcerans extragenic suppressor protein SuhB 0.0079 0.0306 0.3705
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0108 0.0482 0.37
Echinococcus granulosus glycogen phosphorylase 0.0112 0.0512 0.0643
Mycobacterium ulcerans aldehyde dehydrogenase 0.0062 0.0202 0.2225
Toxoplasma gondii inositol(myo)-1(or 4)-monophosphatase 2, putative 0.0079 0.0306 0.3705
Echinococcus granulosus beta LACTamase domain containing family member 0.0037 0.0045 0.0021
Trypanosoma brucei hypothetical protein, conserved 0.0102 0.0451 0.0886
Trichomonas vaginalis glycogen phosphorylase, putative 0.0112 0.0512 0.1019
Trypanosoma cruzi ribonuclease H1, putative 0.0091 0.0381 0.0734
Schistosoma mansoni thyroid hormone receptor 0.015 0.0741 0.0948
Schistosoma mansoni lipoxygenase 0.0056 0.0165 0.0182
Schistosoma mansoni lamin 0.0055 0.0157 0.0171
Loa Loa (eye worm) beta-lactamase 0.0037 0.0045 0.0343
Schistosoma mansoni inositol monophosphatase 0.0079 0.0306 0.0369
Trypanosoma cruzi myo-inositol-1(or 4)-monophosphatase 1, putative 0.0079 0.0306 0.057
Mycobacterium tuberculosis Inositol-1-monophosphatase SuhB 0.0071 0.0255 0.1726
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0052 0.014 0.1077
Brugia malayi Latrophilin receptor protein 2 0.0034 0.0029 0.0219
Mycobacterium leprae probable thymidylate kinase Tmk (dTMP KINASE) (THYMIDYLIC ACID KINASE) (TMPK) 0.0151 0.075 1
Echinococcus granulosus ribonuclease H1 0.0091 0.0381 0.0469
Schistosoma mansoni thymidylate kinase 0.0151 0.075 0.096
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0037 0.0045 0.0021
Schistosoma mansoni aldehyde dehydrogenase 0.0062 0.0202 0.023
Loa Loa (eye worm) inositol-1 0.0079 0.0306 0.2347
Leishmania major myo-inositol-1(or 4)-monophosphatase 1, putative 0.0079 0.0306 0.057
Echinococcus multilocularis DNA (apurinic or apyrimidinic site) lyase 0.0059 0.0182 0.0154
Trichomonas vaginalis ribonuclease H1, putative 0.0091 0.0381 0.0734
Brugia malayi RNase H family protein 0.0091 0.0381 0.2923
Wolbachia endosymbiont of Brugia malayi fructose-1,6-bisphosphatase 0.0079 0.0306 0.2178
Trichomonas vaginalis thymidine kinase, putative 0.078 0.4628 1
Schistosoma mansoni thymidine kinase 0.1252 0.7541 1
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0234 0.1263 1
Entamoeba histolytica glycogen phosphorylase, putative 0.0112 0.0512 0.1019
Brugia malayi hypothetical protein 0.0037 0.0044 0.0341
Plasmodium vivax thymidylate kinase, putative 0.0151 0.075 1
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Loa Loa (eye worm) hypothetical protein 0.0054 0.0151 0.116
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0052 0.014 0.0149
Schistosoma mansoni hypothetical protein 0.011 0.0494 0.062
Schistosoma mansoni hypothetical protein 0.0037 0.0044 0.0021
Echinococcus granulosus Thymidine kinase 2 mitochondrial 0.1252 0.7541 1
Echinococcus multilocularis ribonuclease H1 0.0091 0.0381 0.0353
Echinococcus multilocularis survival motor neuron protein 1 0.0241 0.1303 0.1278
Trypanosoma cruzi apurinic/apyrimidinic endonuclease, putative 0.0059 0.0182 0.03
Loa Loa (eye worm) hypothetical protein 0.0108 0.0482 0.37
Brugia malayi latrophilin 2 splice variant baaae 0.0074 0.0272 0.2089
Trypanosoma cruzi UMP-CMP kinase, mitochondrial, putative 0.0059 0.0184 0.0304
Trichomonas vaginalis thymidylate kinase, putative 0.0151 0.075 0.1539
Trypanosoma brucei retrotransposon hot spot protein 4 (RHS4), interrupted 0.0102 0.0451 0.0886
Brugia malayi hypothetical protein 0.0035 0.0033 0.0256
Trypanosoma cruzi PAB1-binding protein , putative 0.0054 0.0151 0.0232
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0052 0.014 0.0112
Toxoplasma gondii LsmAD domain-containing protein 0.0054 0.0151 0.1511
Trypanosoma brucei apurinic/apyrimidinic endonuclease, putative 0.0059 0.0182 0.03
Loa Loa (eye worm) hypothetical protein 0.0037 0.0045 0.0343
Echinococcus granulosus lamin dm0 0.0055 0.0157 0.0171

Activities

Activity type Activity value Assay description Source Reference
Concentration (functional) = 6.04 uM Concentration required to double plasma clotting prothrombin time ChEMBL. 15261269
Concentration (functional) = 6.04 uM Concentration required to double plasma clotting prothrombin time ChEMBL. 15261269
Concentration (functional) = 8.26 uM Concentration required to double plasma clotting activated partial thromboplastin time ChEMBL. 15261269
Concentration (functional) = 8.26 uM Concentration required to double plasma clotting activated partial thromboplastin time ChEMBL. 15261269
IC50 (functional) = 0.23 uM Inhibitory concentration in dilute prothrombin time assay ChEMBL. 15261269
IC50 (functional) = 0.23 uM Inhibitory concentration in dilute prothrombin time assay ChEMBL. 15261269
Ki (binding) = 14 nM Inhibitory activity against serine protease factor Xa ChEMBL. 15261269
Ki (binding) = 14 nM Inhibitory activity against serine protease factor Xa ChEMBL. 15261269
Ki (binding) > 10 uM Inhibitory activity against coagulation factor II (thrombin) ChEMBL. 15261269
Ki (binding) > 10 uM Inhibitory activity against coagulation factor Kallikrein ChEMBL. 15261269
Ki (binding) > 10 uM Inhibitory activity against coagulation factor II (thrombin) ChEMBL. 15261269
Ki (binding) > 10 uM Inhibitory activity against coagulation factor Kallikrein ChEMBL. 15261269
Ki (binding) > 100 uM Inhibitory activity against coagulation factor trypsin ChEMBL. 15261269
Ki (binding) > 100 uM Inhibitory activity against human tissue plasminogen activator ChEMBL. 15261269
Ki (binding) > 100 uM Inhibitory activity against coagulation factor trypsin ChEMBL. 15261269
Ki (binding) > 100 uM Inhibitory activity against human tissue plasminogen activator ChEMBL. 15261269

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.

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