Detailed information for compound 1530813

Basic information

Technical information
  • TDR Targets ID: 1530813
  • Name: 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(1,3-t hiazol-2-yl)acetamide
  • MW: 320.385 | Formula: C15H17FN4OS
  • H donors: 1 H acceptors: 2 LogP: 2.22 Rotable bonds: 5
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1nccs1)CN1CCN(CC1)c1ccc(cc1)F
  • InChi: 1S/C15H17FN4OS/c16-12-1-3-13(4-2-12)20-8-6-19(7-9-20)11-14(21)18-15-17-5-10-22-15/h1-5,10H,6-9,11H2,(H,17,18,21)
  • InChiKey: WXGIREMEFHFTRW-UHFFFAOYSA-N  


Substructure search Similarity search

Network

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Synonyms

  • 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-thiazol-2-yl-acetamide
  • 2-[4-(4-fluorophenyl)-1-piperazinyl]-N-(2-thiazolyl)acetamide
  • 2-[4-(4-fluorophenyl)piperazin-1-yl]-N-(1,3-thiazol-2-yl)ethanamide
  • STK235311

Targets

Known targets for this compound

Species Target name Source Bibliographic reference
Homo sapiens geminin, DNA replication inhibitor Starlite/ChEMBL No references
Mus musculus solute carrier family 27 (fatty acid transporter), member 1 Starlite/ChEMBL References
Homo sapiens glutaminase Starlite/ChEMBL No references
Homo sapiens solute carrier family 27 (fatty acid transporter), member 1 Starlite/ChEMBL References
Homo sapiens ubiquitin specific peptidase 1 Starlite/ChEMBL No references
Homo sapiens lysine (K)-specific demethylase 4A Starlite/ChEMBL No references

Predicted pathogen targets for this compound

By orthology
Species Potential target Known druggable target/s Ortholog Group
Mycobacterium ulcerans long-chain-acyl-CoA synthetase Get druggable targets OG5_127399 All targets in OG5_127399
Trypanosoma cruzi fatty acid transporter protein-like, putative Get druggable targets OG5_127399 All targets in OG5_127399
Leishmania braziliensis fatty acid transporter protein-like protein Get druggable targets OG5_127399 All targets in OG5_127399
Echinococcus multilocularis Transcription factor, JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus multilocularis long chain fatty acid transport protein 4 Get druggable targets OG5_127399 All targets in OG5_127399
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans similar to S. cerevisiae FAT1 (YBR041W) fatty acid transporter and very long-chain fatty acyl-CoA synthetase Get druggable targets OG5_127399 All targets in OG5_127399
Brugia malayi AMP-binding enzyme family protein Get druggable targets OG5_127399 All targets in OG5_127399
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD6 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) Get druggable targets OG5_127399 All targets in OG5_127399
Trypanosoma cruzi fatty acid transporter protein-like, putative Get druggable targets OG5_127399 All targets in OG5_127399
Loa Loa (eye worm) glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Loa Loa (eye worm) AMP-binding enzyme family protein Get druggable targets OG5_127399 All targets in OG5_127399
Brugia malayi glutaminase DH11.1 Get druggable targets OG5_129245 All targets in OG5_129245
Schistosoma mansoni FFA transport protein Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Loa Loa (eye worm) glutaminase 2 Get druggable targets OG5_129245 All targets in OG5_129245
Schistosoma japonicum ko:K08745 solute carrier family 27 (fatty acid transporter), member 1, putative Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma mansoni jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Brugia malayi jmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania major fatty acid transporter protein-like protein Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma mansoni glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Loa Loa (eye worm) hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus long chain fatty acid transport protein 4 Get druggable targets OG5_127399 All targets in OG5_127399
Candida albicans similar to S. cerevisiae FAT1 (YBR041W) fatty acid transporter and very long-chain fatty acyl-CoA synthetase Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma japonicum expressed protein Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania infantum fatty acid transporter protein-like protein Get druggable targets OG5_127399 All targets in OG5_127399
Echinococcus granulosus jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Mycobacterium ulcerans glutaminase Get druggable targets OG5_129245 All targets in OG5_129245
Plasmodium yoelii hypothetical protein Get druggable targets OG5_127917 All targets in OG5_127917
Trichomonas vaginalis glutaminase, putative Get druggable targets OG5_129245 All targets in OG5_129245
Leishmania mexicana fatty acid transporter protein-like protein Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma japonicum Probable JmjC domain-containing histone demethylation protein 3B, putative Get druggable targets OG5_127917 All targets in OG5_127917
Echinococcus granulosus Transcription factor JmjC domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Schistosoma japonicum Long-chain fatty acid transport protein 4, putative Get druggable targets OG5_127399 All targets in OG5_127399
Echinococcus multilocularis jumonji domain containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Mycobacterium leprae possible long-chain acyl-CoA synthase Get druggable targets OG5_127399 All targets in OG5_127399
Loa Loa (eye worm) jmjC domain-containing protein Get druggable targets OG5_127917 All targets in OG5_127917
Candida albicans one of two closely related potential jumonji-like transcription factor genes similar to S. cerevisiae RPH1 (YER169W) damage-resp Get druggable targets OG5_127917 All targets in OG5_127917
Leishmania donovani fatty acid transporter protein-like protein Get druggable targets OG5_127399 All targets in OG5_127399
Schistosoma japonicum JmjC domain-containing histone demethylation protein 3C, putative Get druggable targets OG5_127917 All targets in OG5_127917
By sequence similarity to non orthologous known druggable targets
Species Potential target Known druggable target Length Alignment span Identity
Brugia malayi Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X geminin, DNA replication inhibitor 209 aa 176 aa 27.8 %
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) solute carrier family 27 (fatty acid transporter), member 1 646 aa 552 aa 22.8 %
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 solute carrier family 27 (fatty acid transporter), member 1 646 aa 519 aa 20.4 %
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Mycobacterium tuberculosis NADPH-dependent mycothiol reductase Mtr 0.0054 0.0454 0.1432
Echinococcus granulosus lysine specific demethylase 5A 0.0043 0.0309 0.0133
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Toxoplasma gondii thioredoxin reductase 0.0054 0.0454 1
Loa Loa (eye worm) TAR-binding protein 0.0072 0.0692 0.1591
Trypanosoma cruzi fatty acid transporter protein-like, putative 0.0225 0.2693 1
Mycobacterium tuberculosis Probable hydrolase 0.0041 0.0286 0.0903
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Mycobacterium tuberculosis Probable conserved lipoprotein 0.0041 0.0286 0.0903
Brugia malayi jmjC domain containing protein 0.0043 0.0309 0.0295
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Brugia malayi AMP-binding enzyme family protein 0.0239 0.2876 0.6916
Trypanosoma cruzi trypanothione reductase, putative 0.0054 0.0454 0.0696
Echinococcus granulosus Transcription factor JmjC domain containing protein 0.0115 0.1261 0.1102
Mycobacterium ulcerans acyl-CoA synthetase 0.0037 0.0236 0.0457
Loa Loa (eye worm) beta-LACTamase domain containing family member 0.0041 0.0286 0.0581
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0037 0.0236 0.0457
Brugia malayi beta-lactamase 0.0041 0.0286 0.0236
Brugia malayi AMP-binding enzyme family protein 0.0037 0.0236 0.0108
Mycobacterium tuberculosis Conserved protein 0.0041 0.0286 0.0903
Echinococcus granulosus geminin 0.0205 0.243 0.2292
Loa Loa (eye worm) hypothetical protein 0.0037 0.0236 0.0457
Loa Loa (eye worm) pre-SET domain-containing protein family protein 0.0236 0.2842 0.694
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0212 0.0675
Plasmodium falciparum glutathione reductase 0.0054 0.0454 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0037 0.0236 0.0457
Loa Loa (eye worm) thioredoxin reductase 0.0054 0.0454 0.0997
Mycobacterium tuberculosis Probable NADH dehydrogenase Ndh 0.0122 0.1353 0.4272
Mycobacterium tuberculosis Probable lipase LipE 0.0041 0.0286 0.0903
Brugia malayi beta-lactamase family protein 0.0041 0.0286 0.0236
Loa Loa (eye worm) hypothetical protein 0.0035 0.0212 0.0397
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Loa Loa (eye worm) beta-lactamase 0.0041 0.0286 0.0581
Onchocerca volvulus 0.0041 0.0286 0.0297
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Mycobacterium tuberculosis Possible conserved lipoprotein LpqK 0.0041 0.0286 0.0903
Mycobacterium ulcerans fructose-bisphosphate aldolase 0.0162 0.1872 0.4526
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0309 0.0117
Plasmodium vivax SET domain protein, putative 0.0034 0.0195 0.3542
Loa Loa (eye worm) glutathione reductase 0.0054 0.0454 0.0997
Mycobacterium ulcerans hypothetical protein 0.0041 0.0286 0.0581
Onchocerca volvulus 0.0037 0.0236 0.0136
Mycobacterium tuberculosis Probable esterase LipL 0.0041 0.0286 0.0903
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0037 0.0236 0.0457
Trypanosoma cruzi fatty acid transporter protein-like, putative 0.0225 0.2693 1
Echinococcus multilocularis thioredoxin glutathione reductase 0.0054 0.0454 0.0264
Brugia malayi TAR-binding protein 0.0072 0.0692 0.1283
Mycobacterium tuberculosis Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB 0.0122 0.1353 0.4272
Mycobacterium tuberculosis Putative ferredoxin reductase 0.0122 0.1353 0.4272
Onchocerca volvulus 0.0041 0.0286 0.0297
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0332 0.4092 1
Trichomonas vaginalis glutaminase, putative 0.033 0.4072 0.9948
Mycobacterium ulcerans fusion of enoyl-CoA hydratase, EchA21 and lipase, LipE 0.0041 0.0286 0.0581
Mycobacterium tuberculosis Probable reductase 0.0122 0.1353 0.4272
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0037 0.0236 0.0457
Echinococcus multilocularis lysine specific demethylase 5A 0.0043 0.0309 0.0117
Brugia malayi PHD-finger family protein 0.0035 0.0212 0.0045
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0037 0.0236 0.0457
Mycobacterium ulcerans lipase LipD 0.0041 0.0286 0.0581
Brugia malayi Thioredoxin reductase 0.0054 0.0454 0.0668
Schistosoma mansoni hypothetical protein 0.0205 0.243 0.2279
Loa Loa (eye worm) hypothetical protein 0.006 0.0541 0.1216
Loa Loa (eye worm) hypothetical protein 0.0037 0.0236 0.0457
Loa Loa (eye worm) hypothetical protein 0.0037 0.0236 0.0457
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0286 0.0093
Schistosoma mansoni tar DNA-binding protein 0.0072 0.0692 0.0507
Leishmania major trypanothione reductase 0.0054 0.0454 0.0904
Onchocerca volvulus 0.0041 0.0286 0.0297
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0037 0.0236 0.0746
Schistosoma mansoni jumonji/arid domain-containing protein 0.0043 0.0309 0.0117
Echinococcus multilocularis geminin 0.0205 0.243 0.2279
Plasmodium vivax hypothetical protein, conserved 0.0035 0.0212 0.3978
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Mycobacterium tuberculosis Probable dehydrogenase 0.0122 0.1353 0.4272
Brugia malayi glutaminase DH11.1 0.033 0.4072 1
Leishmania major hypothetical protein, conserved 0.0041 0.0286 0.0207
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0023 0.0053 0.5
Echinococcus multilocularis long chain fatty acid transport protein 4 0.0225 0.2693 0.2548
Echinococcus multilocularis beta LACTamase domain containing family member 0.0041 0.0286 0.0093
Echinococcus multilocularis Transcription factor, JmjC domain containing protein 0.0115 0.1261 0.1087
Mycobacterium ulcerans acyl-CoA synthetase 0.0037 0.0236 0.0457
Echinococcus granulosus tar DNA binding protein 0.0072 0.0692 0.0523
Brugia malayi Hypothetical 52.5 kDa protein ZK945.1 in chromosome II, putative 0.0041 0.0286 0.0236
Mycobacterium tuberculosis Probable lipase LipD 0.0041 0.0286 0.0903
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD6 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0221 0.264 0.8335
Mycobacterium tuberculosis Probable esterase/lipase LipP 0.0041 0.0286 0.0903
Schistosoma mansoni bromodomain-containing nuclear protein 1 brd1 0.0035 0.0212 0.0018
Trypanosoma brucei trypanothione reductase 0.0054 0.0454 1
Loa Loa (eye worm) RNA binding protein 0.0072 0.0692 0.1591
Echinococcus granulosus beta LACTamase domain containing family member 0.0041 0.0286 0.011
Mycobacterium leprae Probable fructose bisphosphate aldolase Fba 0.0162 0.1872 0.6804
Echinococcus granulosus thioredoxin glutathione reductase 0.0054 0.0454 0.028
Mycobacterium ulcerans esterase/lipase LipP 0.0041 0.0286 0.0581
Plasmodium vivax hypothetical protein, conserved 0.0041 0.0286 0.5821
Plasmodium vivax thioredoxin reductase, putative 0.0054 0.0454 1
Schistosoma mansoni FFA transport protein 0.0225 0.2693 0.2548
Schistosoma mansoni family S12 unassigned peptidase (S12 family) 0.0041 0.0286 0.0093
Plasmodium falciparum phd finger protein, putative 0.0035 0.0212 0.3978
Schistosoma mansoni microtubule-associated protein tau 0.0783 1 1
Schistosoma mansoni jumonji domain containing protein 0.0092 0.095 0.0771
Onchocerca volvulus 0.0269 0.3269 1
Mycobacterium tuberculosis Probable fructose-bisphosphate aldolase Fba 0.0162 0.1872 0.5909
Trichomonas vaginalis set domain proteins, putative 0.0269 0.3269 0.7838
Brugia malayi AMP-binding enzyme family protein 0.0037 0.0236 0.0108
Schistosoma mansoni hypothetical protein 0.0205 0.243 0.2279
Schistosoma mansoni tar DNA-binding protein 0.0072 0.0692 0.0507
Schistosoma mansoni tar DNA-binding protein 0.0072 0.0692 0.0507
Mycobacterium tuberculosis Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras 0.0136 0.1532 0.4836
Loa Loa (eye worm) hypothetical protein 0.0034 0.0195 0.0353
Loa Loa (eye worm) glutaminase 2 0.033 0.4072 1
Mycobacterium ulcerans hypothetical protein 0.0037 0.0236 0.0457
Mycobacterium tuberculosis Possible penicillin-binding protein 0.0261 0.3168 1
Echinococcus multilocularis tar DNA binding protein 0.0072 0.0692 0.0507
Mycobacterium tuberculosis Probable oxidoreductase 0.0136 0.1532 0.4836
Schistosoma mansoni tar DNA-binding protein 0.0072 0.0692 0.0507
Brugia malayi beta-lactamase family protein 0.0041 0.0286 0.0236
Brugia malayi jmjC domain containing protein 0.0115 0.1261 0.2749
Brugia malayi RNA recognition motif domain containing protein 0.0072 0.0692 0.1283
Schistosoma mansoni tar DNA-binding protein 0.0072 0.0692 0.0507
Giardia lamblia Fructose-bisphosphate aldolase 0.0332 0.4092 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Mycobacterium tuberculosis Conserved protein 0.0041 0.0286 0.0903
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0037 0.0236 0.0746
Echinococcus multilocularis peregrin 0.0035 0.0212 0.0018
Toxoplasma gondii ABC1 family protein 0.0041 0.0286 0.3529
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0023 0.0053 0.0166
Mycobacterium tuberculosis Conserved protein 0.0041 0.0286 0.0903
Mycobacterium ulcerans long-chain-acyl-CoA synthetase 0.0239 0.2876 0.7025
Mycobacterium tuberculosis Probable membrane NADH dehydrogenase NdhA 0.0122 0.1353 0.4272
Echinococcus multilocularis PHD finger protein rhinoceros 0.0035 0.0212 0.0018
Brugia malayi Bromodomain containing protein 0.0035 0.0212 0.0045
Loa Loa (eye worm) jmjC domain-containing protein 0.0043 0.0309 0.0638
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Brugia malayi Pre-SET motif family protein 0.0236 0.2842 0.6828
Brugia malayi AMP-binding enzyme family protein 0.0037 0.0236 0.0108
Toxoplasma gondii PHD-finger domain-containing protein 0.0035 0.0212 0.0675
Mycobacterium ulcerans glutaminase 0.033 0.4072 1
Echinococcus granulosus jumonji domain containing protein 0.0049 0.0393 0.0218
Onchocerca volvulus Alhambra homolog 0.0035 0.0212 0.0057
Loa Loa (eye worm) glutaminase 0.033 0.4072 1
Brugia malayi glutathione reductase 0.0054 0.0454 0.0668
Mycobacterium leprae PROBABLE NADH DEHYDROGENASE NDH 0.0122 0.1353 0.4646
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Echinococcus granulosus long chain fatty acid transport protein 4 0.0225 0.2693 0.256
Echinococcus granulosus histone lysine methyltransferase setb 0.0034 0.0195 0.0017
Plasmodium falciparum thioredoxin reductase 0.0054 0.0454 1
Loa Loa (eye worm) PHD-finger family protein 0.0035 0.0212 0.0397
Loa Loa (eye worm) jmjC domain-containing protein 0.0073 0.0703 0.1618
Mycobacterium leprae DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE 0.0136 0.1532 0.539
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Echinococcus multilocularis jumonji domain containing protein 0.0049 0.0393 0.0202
Mycobacterium leprae possible long-chain acyl-CoA synthase 0.0221 0.264 1
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0239 0.2876 0.7025
Plasmodium vivax glutathione reductase, putative 0.0054 0.0454 1
Mycobacterium tuberculosis NAD(P)H quinone reductase LpdA 0.0136 0.1532 0.4836
Leishmania major fatty acid transporter protein-like protein 0.0221 0.264 1
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Brugia malayi RNA binding protein 0.0072 0.0692 0.1283
Mycobacterium ulcerans beta-lactamase 0.0041 0.0286 0.0581
Treponema pallidum fructose-bisphosphate aldolase 0.0332 0.4092 0.5
Mycobacterium leprae conserved hypothetical protein 0.0041 0.0286 0.0207
Loa Loa (eye worm) hypothetical protein 0.0041 0.0286 0.0581
Schistosoma mansoni hypothetical protein 0.0035 0.0212 0.0018
Schistosoma mansoni glutaminase 0.033 0.4072 0.3954
Trichomonas vaginalis fructose-bisphosphate aldolase, putative 0.0332 0.4092 1
Loa Loa (eye worm) RNA recognition domain-containing protein domain-containing protein 0.0072 0.0692 0.1591
Echinococcus granulosus peregrin 0.0035 0.0212 0.0034
Entamoeba histolytica fructose-1,6-bisphosphate aldolase, putative 0.0332 0.4092 1
Echinococcus multilocularis microtubule associated protein 2 0.0783 1 1
Mycobacterium leprae Probable lipase LipE 0.0041 0.0286 0.0207
Echinococcus granulosus PHD finger protein rhinoceros 0.0035 0.0212 0.0034

Activities

Activity type Activity value Assay description Source Reference
IC50 (binding) > 1 uM Inhibition of human FLAG-tagged FATP1-mediated [1-14C] oleic acid conversion to [1-14C] oleoyl-CoA after 20 mins by scintillation counting analysis ChEMBL. 23528296
IC50 (binding) > 10 uM Inhibition of mouse FLAG-tagged FATP1-mediated [1-14C] oleic acid conversion to [1-14C] oleoyl-CoA after 20 mins by scintillation counting analysis ChEMBL. 23528296
Potency (functional) 2.3109 uM PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 12.5893 uM PubChem BioAssay. Inhibitors of USP1/UAF1: Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 19.9526 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of JMJD2A-Tudor Domain. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504402] ChEMBL. No reference
Potency (functional) 19.9526 uM PubChem BioAssay. qHTS for Inhibitors of Glutaminase (GLS). (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 23.7781 uM PubChem BioAssay. qHTS for Inhibitors of PLK1-PDB (polo-like kinase 1 - polo-box domain): Primary Screen. (Class of assay: confirmatory) ChEMBL. No reference
Potency (functional) 89.1251 uM PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] ChEMBL. No reference

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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