Detailed information for compound 736071

Basic information

Technical information
  • TDR Targets ID: 736071
  • Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chlo ro-3-methylphenoxy)acetamide
  • MW: 408.901 | Formula: C22H17ClN2O2S
  • H donors: 1 H acceptors: 2 LogP: 5.91 Rotable bonds: 6
    Rule of 5 violations (Lipinski): 1
  • SMILES: O=C(Nc1ccccc1c1nc2c(s1)cccc2)COc1ccc(c(c1)C)Cl
  • InChi: 1S/C22H17ClN2O2S/c1-14-12-15(10-11-17(14)23)27-13-21(26)24-18-7-3-2-6-16(18)22-25-19-8-4-5-9-20(19)28-22/h2-12H,13H2,1H3,(H,24,26)
  • InChiKey: YJQZCFQJKMZUEA-UHFFFAOYSA-N  


Substructure search Similarity search

Network

Hover on a compound node to display the structore

Synonyms

  • N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-3-methyl-phenoxy)acetamide
  • N-[2-(1,3-benzothiazol-2-yl)phenyl]-2-(4-chloro-3-methyl-phenoxy)ethanamide
  • STK254828
  • CBKinase1_004880
  • ZINC01837828
  • CBKinase1_017280

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
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
Mycobacterium tuberculosis Probable peptide synthetase Nrp (peptide synthase) 0.0014 0.0118 0.0546
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 7 0.0022 0.0215 0.3373
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0062 0.0704 0.1204
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0022 0.0215 1
Plasmodium falciparum acyl-CoA synthetase 0.0036 0.0379 1
Onchocerca volvulus 0.0022 0.0215 0.2391
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Echinococcus multilocularis potassium channel subfamily K 8 0.0022 0.0215 0.0178
Trypanosoma cruzi ion transport protein, putative 0.0022 0.0215 1
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.0524 1
Leishmania major hypothetical protein, conserved 0.0022 0.0215 0.2391
Loa Loa (eye worm) large conductance calcium-activated potassium channel alpha subunit ai 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 19. C. elegans unc-58 ortholog 0.0022 0.0215 0.3373
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD35 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.0355 0.6071
Echinococcus multilocularis twik family of potassium channels 0.0022 0.0215 0.0178
Loa Loa (eye worm) oxidoreductase 0.0014 0.0118 0.0102
Trypanosoma cruzi hypothetical protein, conserved 0.0022 0.0215 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Echinococcus granulosus calcium activated potassium channel variant 0.0022 0.0215 0.0306
Loa Loa (eye worm) hypothetical protein 0.0048 0.0524 0.0804
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD10 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0118 0.0546
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 28 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.016 0.1884 0.3153
Brugia malayi Twik (KCNK-like) family of potasium channels, alpha subunit 40 0.0022 0.0215 0.3373
Brugia malayi hypothetical protein 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trypanosoma cruzi calcium/potassium channel (CAKC), putative 0.0022 0.0215 1
Schistosoma mansoni acetyl-CoA synthetase 0.0014 0.0118 0.0202
Schistosoma mansoni calcium-activated potassium channel 0.0022 0.0215 0.0368
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Echinococcus granulosus cpg binding protein 0.0031 0.0325 0.0495
Leishmania major calcium/potassium channel (CAKC), putative 0.0022 0.0215 0.2391
Mycobacterium tuberculosis Possible transmembrane cation transporter 0.0022 0.0215 0.2806
Mycobacterium tuberculosis Peptide synthetase MbtE (peptide synthase) 0.0014 0.0118 0.0546
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0118 0.129
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Mycobacterium tuberculosis Probable medium chain fatty-acid-CoA ligase FadD14 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0118 0.0546
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Onchocerca volvulus 0.0022 0.0215 0.2391
Loa Loa (eye worm) hypothetical protein 0.0079 0.0909 0.1469
Echinococcus multilocularis potassium channel subfamily K 0.0022 0.0215 0.0178
Loa Loa (eye worm) CXXC zinc finger family protein 0.0029 0.0305 0.0425
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.0524 1
Echinococcus multilocularis acetyl coenzyme A synthetase, cytoplasmic 0.0014 0.0118 0.0081
Brugia malayi AMP-binding enzyme family protein 0.0048 0.0524 1
Toxoplasma gondii histone lysine methyltransferase SET1 0.0056 0.0623 1
Onchocerca volvulus 0.0022 0.0215 0.2391
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 38. C. elegans sup-9 ortholog 0.0022 0.0215 0.3373
Onchocerca volvulus 0.0022 0.0215 0.2391
Toxoplasma gondii ion channel protein 0.0022 0.0215 0.1922
Brugia malayi AMP-binding enzyme family protein 0.0048 0.0524 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD7 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.0355 0.6071
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0014 0.0118 0.0102
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0022 0.0215 1
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD2 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0048 0.0524 1
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0118 0.0102
Leishmania major potassium channel subunit-like protein 0.0022 0.0215 0.2391
Schistosoma mansoni cpg binding protein 0.0031 0.0325 0.0556
Schistosoma mansoni calcium-activated potassium channel 0.0022 0.0215 0.0368
Loa Loa (eye worm) TWK-28 protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 13 0.0022 0.0215 0.3373
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 32 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trypanosoma brucei calcium-activated potassium channel, putative 0.0022 0.0215 1
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Loa Loa (eye worm) TWK-7 protein 0.0022 0.0215 0.0269
Echinococcus multilocularis calcium activated potassium channel variant 0.0022 0.0215 0.0178
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0022 0.0215 1
Echinococcus granulosus twik family of potassium channels 0.0022 0.0215 0.0306
Mycobacterium tuberculosis Probable chain -fatty-acid-CoA ligase FadD13 (fatty-acyl-CoA synthetase) 0.0048 0.0524 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trypanosoma cruzi hypothetical protein, conserved 0.0022 0.0215 1
Echinococcus granulosus potassium channel subfamily K 8 0.0022 0.0215 0.0306
Onchocerca volvulus 0.0022 0.0215 0.2391
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD8 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0118 0.0546
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Chlamydia trachomatis acylglycerophosphoethanolamine acyltransferase 0.0036 0.0379 0.5
Trypanosoma brucei calcium/potassium channel (CAKC), putative 0.0022 0.0215 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0022 0.0215 1
Brugia malayi AMP-binding enzyme family protein 0.0048 0.0524 1
Loa Loa (eye worm) potassium voltage-gated channel subfamily Q member 5 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 12 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.0036 0.0379 0.0553
Mycobacterium tuberculosis Possible fatty-acid-CoA ligase FadD1 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0014 0.0118 0.0546
Schistosoma mansoni cpg binding protein 0.0031 0.0325 0.0556
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0118 0.129
Brugia malayi acetyl-Coenzyme A synthetase 2 0.0014 0.0118 0.129
Mycobacterium ulcerans transmembrane cation transporter 0.0022 0.0215 0.2391
Loa Loa (eye worm) hypothetical protein 0.0048 0.0524 0.0804
Echinococcus multilocularis dnaJ subfamily B 0.0419 0.5019 0.5
Loa Loa (eye worm) AMP-binding enzyme family protein 0.0014 0.0118 0.0102
Mycobacterium ulcerans ion transport protein 0.0022 0.0215 0.2391
Leishmania major hypothetical protein, conserved 0.0022 0.0215 0.2391
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD3 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.0355 0.6071
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 21 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0118 0.476
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Schistosoma mansoni cpg binding protein 0.0029 0.0305 0.0522
Echinococcus multilocularis cpg binding protein 0.0031 0.0325 0.0289
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 30. 0.0022 0.0215 0.3373
Brugia malayi hypothetical protein 0.0022 0.0215 0.3373
Echinococcus granulosus dnaJ subfamily B 0.0419 0.5019 0.8575
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 35 0.0022 0.0215 0.3373
Plasmodium falciparum potassium channel 0.0022 0.0215 0.3723
Schistosoma mansoni twik family of potassium channels-related 0.0022 0.0215 0.0368
Brugia malayi CXXC zinc finger family protein 0.0029 0.0305 0.5299
Echinococcus multilocularis small conductance calcium activated potassium 0.0487 0.5847 0.5831
Plasmodium vivax potassium channel, putative 0.0022 0.0215 0.3723
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Entamoeba histolytica acyl-CoA synthetase, putative 0.0048 0.0524 1
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0048 0.0524 1
Echinococcus granulosus histone lysine N methyltransferase MLL3 0.0009 0.0059 0.0037
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.0524 1
Plasmodium vivax acyl-CoA synthetase, putative 0.0036 0.0379 1
Leishmania major ion transport protein-like protein 0.0022 0.0215 0.2391
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Mycobacterium ulcerans fatty-acid-CoA ligase 0.0036 0.0379 0.6421
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.0524 1
Trypanosoma cruzi calcium-activated potassium channel, putative 0.0022 0.0215 1
Mycobacterium ulcerans acyl-CoA synthetase 0.0048 0.0524 1
Giardia lamblia Hypothetical protein 0.0022 0.0215 0.5
Loa Loa (eye worm) hypothetical protein 0.0036 0.0379 0.0553
Loa Loa (eye worm) hypothetical protein 0.0036 0.0379 0.0553
Onchocerca volvulus 0.0022 0.0215 0.2391
Mycobacterium tuberculosis Fatty-acid-CoA synthetase FadD17 (fatty-acid-CoA synthase) (fatty-acid-CoA ligase) 0.0014 0.0118 0.0546
Loa Loa (eye worm) hypothetical protein 0.0014 0.0118 0.0102
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0022 0.0215 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Entamoeba histolytica acyl-CoA synthetase, putative 0.0048 0.0524 1
Echinococcus multilocularis TWiK family of potassium channels protein 7 0.0022 0.0215 0.0178
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39A 0.0022 0.0215 0.3373
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD2 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0048 0.0524 1
Loa Loa (eye worm) S-phase kinase-associated protein 1A 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 17 0.0022 0.0215 0.3373
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 24 0.0022 0.0215 0.3373
Trichomonas vaginalis antibiotic synthetase, putative 0.0014 0.0118 0.476
Plasmodium falciparum potassium channel 0.0022 0.0215 0.3723
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 45 0.0022 0.0215 0.3373
Schistosoma mansoni calcium-activated potassium channel 0.0386 0.462 0.7903
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Echinococcus granulosus twik family of potassium channels 0.0022 0.0215 0.0306
Mycobacterium ulcerans long-chain-fatty-acid-CoA ligase 0.0048 0.0524 1
Echinococcus granulosus small conductance calcium activated potassium 0.0487 0.5847 1
Schistosoma mansoni hypothetical protein 0.0419 0.5019 0.8584
Entamoeba histolytica calcium-gated potassium channel protein, putative 0.0022 0.0215 0.2391
Schistosoma mansoni hypothetical protein 0.0487 0.5847 1
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0118 0.129
Brugia malayi oxidoreductase, short chain dehydrogenase/reductase family protein 0.0014 0.0118 0.129
Trypanosoma cruzi ion transport protein, putative 0.0022 0.0215 1
Loa Loa (eye worm) uncoordinated protein 58 0.0022 0.0215 0.0269
Echinococcus granulosus TWiK family of potassium channels protein 7 0.0022 0.0215 0.0306
Onchocerca volvulus 0.0029 0.0305 0.4602
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Leishmania major 4-coumarate:coa ligase-like protein 0.0048 0.0524 1
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0022 0.0215 1
Mycobacterium ulcerans long-chain fatty-acid CoA ligase 0.0048 0.0524 1
Onchocerca volvulus 0.0048 0.0524 1
Echinococcus multilocularis Two pore potassium channel protein sup 9 0.0022 0.0215 0.0178
Schistosoma mansoni calcium-activated potassium channel 0.0487 0.5847 1
Mycobacterium tuberculosis Fatty-acid-AMP ligase FadD30 (fatty-acid-AMP synthetase) (fatty-acid-AMP synthase) 0.0036 0.0379 0.6617
Loa Loa (eye worm) hypothetical protein 0.0487 0.5847 1
Loa Loa (eye worm) hypothetical protein 0.0036 0.0379 0.0553
Entamoeba histolytica acyl-coA synthetase, putative 0.0048 0.0524 1
Echinococcus multilocularis twik family of potassium channels 0.0022 0.0215 0.0178
Mycobacterium tuberculosis Peptide synthetase MbtF (peptide synthase) 0.0014 0.0118 0.0546
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Echinococcus granulosus acetyl coenzyme A synthetase cytoplasmic 0.0014 0.0118 0.0139
Toxoplasma gondii ion channel protein 0.0022 0.0215 0.1922
Loa Loa (eye worm) hypothetical protein 0.0226 0.2685 0.4538
Mycobacterium leprae PROBABLE FATTY-ACID-CoA LIGASE FADD7 (FATTY-ACID-CoA SYNTHETASE) (FATTY-ACID-CoA SYNTHASE) 0.0048 0.0524 1
Echinococcus granulosus Two pore potassium channel protein sup 9 0.0022 0.0215 0.0306
Loa Loa (eye worm) hypothetical protein 0.0048 0.0524 0.0804
Mycobacterium ulcerans hypothetical protein 0.0048 0.0524 1
Plasmodium vivax potassium channel, putative 0.0022 0.0215 0.3723
Echinococcus multilocularis potassium channel subfamily K 8 0.0022 0.0215 0.0178
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 39B 0.0022 0.0215 0.3373
Loa Loa (eye worm) hypothetical protein 0.0036 0.0379 0.0553
Loa Loa (eye worm) hypothetical protein 0.0022 0.0215 0.0269
Echinococcus multilocularis histone lysine N methyltransferase MLL3 0.0009 0.0059 0.0022
Brugia malayi AMP-binding enzyme family protein 0.0014 0.0118 0.129
Brugia malayi Twik (KCNK-like) family of potassium channels, alpha subunit 5 0.0022 0.0215 0.3373
Trichomonas vaginalis voltage and ligand gated potassium channel, putative 0.0022 0.0215 1
Onchocerca volvulus 0.0022 0.0215 0.2391
Schistosoma mansoni hypothetical protein 0.0022 0.0215 0.0368
Echinococcus granulosus potassium channel subfamily K 0.0022 0.0215 0.0306
Echinococcus granulosus potassium channel subfamily K 8 0.0022 0.0215 0.0306
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0007 0.0037 0.0064
Mycobacterium tuberculosis Probable fatty-acid-CoA ligase FadD5 (fatty-acid-CoA synthetase) (fatty-acid-CoA synthase) 0.0034 0.0355 0.6071
Mycobacterium ulcerans long-chain-fatty-acid--CoA ligase 0.0048 0.0524 1
Mycobacterium tuberculosis Bifunctional enzyme MbtA: salicyl-AMP ligase (SAL-AMP ligase) + salicyl-S-ArCP synthetase 0.0014 0.0118 0.0546
Onchocerca volvulus 0.0022 0.0215 0.2391
Mycobacterium tuberculosis Phenyloxazoline synthase MbtB (phenyloxazoline synthetase) 0.0014 0.0118 0.0546
Mycobacterium tuberculosis P-hydroxybenzoyl-AMP ligase FadD22 0.0014 0.0118 0.0546

Activities

No activities found for this compound.

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

No literature references available for this target.

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