TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 529.481 | Formula: C26H26Cl2N4O2S
H donors: 1 H acceptors: 2 LogP: 5.17 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: NCCCN(C(c1nc2ccsc2c(=O)n1Cc1ccccc1)CC)C(=O)c1ccc(cc1Cl)Cl
InChi: 1S/C26H26Cl2N4O2S/c1-2-22(31(13-6-12-29)25(33)19-10-9-18(27)15-20(19)28)24-30-21-11-14-35-23(21)26(34)32(24)16-17-7-4-3-5-8-17/h3-5,7-11,14-15,22H,2,6,12-13,16,29H2,1H3
InChiKey: VCZNSIOBRPJWNC-UHFFFAOYSA-N

Network

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Target Layer

Model Organisms

Species	Viewmode
Arabidopsis thaliana
Caenorhabditis elegans
Dictyostelium discoideum
Drosophila melanogaster
Escherichia coli
Homo sapiens
Mus musculus
Oryza sativa
Saccharomyces cerevisiae
Schmidtea mediterranea
Other organisms

TDR Pathogens:

Species	Viewmode
Brugia malayi
Chlamydia trachomatis
Echinococcus granulosus
Entamoeba histolytica
Echinococcus multilocularis
Giardia lamblia
Leishmania major
Loa Loa (eye worm)
Mycobacterium leprae
Mycobacterium tuberculosis
Mycobacterium ulcerans
Onchocerca volvulus
Plasmodium falciparum
Plasmodium vivax
Schistosoma mansoni
Trypanosoma brucei
Trypanosoma cruzi
Toxoplasma gondii
Treponema pallidum
Trichomonas vaginalis
Wolbachia endosymbiont of Brugia malayi

Other Pathogens:

Species	Viewmode
Babesia bovis
Candida albicans
Cryptosporidium hominis
Cryptosporidium parvum
Leishmania braziliensis
Leishmania donovani
Leishmania infantum
Leishmania mexicana
Neospora caninum
Plasmodium berghei
Plasmodium knowlesi
Plasmodium yoelii
Schistosoma japonicum
Trypanosoma brucei gambiense
Trypanosoma congolense
Theileria parva

Compound Layer

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Clustering layers

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Synonyms

No synonyms found for this compound

Targets

Known targets for this compound

Species	Target name	Source	Bibliographic reference
Homo sapiens	kinesin family member 11	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Schistosoma japonicum	ko:K10398 kinesin family member 11, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Cryptosporidium parvum	kinesin-like boursin, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Echinococcus multilocularis	kinesin family 1	Get druggable targets OG5_128460	All targets in OG5_128460
Neospora caninum	hypothetical protein	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium knowlesi	kinesin-5, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Toxoplasma gondii	kinesin motor domain-containing protein	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium berghei	kinesin-5, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Brugia malayi	Kinesin motor domain containing protein	Get druggable targets OG5_128460	All targets in OG5_128460
Candida albicans	kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein	Get druggable targets OG5_128460	All targets in OG5_128460
Entamoeba histolytica	kinesin, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Candida albicans	kinesin motor domain protein similar to S. cerevisiae KIP1 (YBL063W) microtubule motor complex protein	Get druggable targets OG5_128460	All targets in OG5_128460
Echinococcus granulosus	kinesin family 1	Get druggable targets OG5_128460	All targets in OG5_128460
Cryptosporidium hominis	kinesin-like boursin	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium falciparum	kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Loa Loa (eye worm)	kinesin-like protein KLP2	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium vivax	kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Giardia lamblia	Kinesin-5	Get druggable targets OG5_128460	All targets in OG5_128460
Plasmodium yoelii	Kinesin motor domain, putative	Get druggable targets OG5_128460	All targets in OG5_128460
Schistosoma mansoni	kinesin eg-5	Get druggable targets OG5_128460	All targets in OG5_128460

By sequence similarity to non orthologous known druggable targets

No druggable targets predicted by sequence similarity

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	chromobox protein, putative	0.0043	0.0358	0.5254
Loa Loa (eye worm)	hypothetical protein	0.0058	0.0519	0.606
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Brugia malayi	Bromodomain containing protein	0.0085	0.0831	0.9751
Trichomonas vaginalis	chromobox protein, putative	0.0043	0.0358	0.5254
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.0068	0.064	0.079
Trichomonas vaginalis	conserved hypothetical protein	0.0015	0.0046	0.0599
Schistosoma mansoni	hypothetical protein	0.0017	0.0067	0.0075
Echinococcus multilocularis	lamin	0.0059	0.0531	0.0525
Schistosoma mansoni	sex comb on midleg homolog	0.0053	0.0471	0.058
Loa Loa (eye worm)	hypothetical protein	0.0027	0.018	0.2051
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0324	0.4746
Loa Loa (eye worm)	hypothetical protein	0.0059	0.0531	0.6202
Schistosoma mansoni	intermediate filament proteins	0.0059	0.0531	0.0654
Schistosoma mansoni	kinesin eg-5	0.0032	0.0235	0.0285
Brugia malayi	Protein cec-1.	0.0012	0.0006	0.0074
Brugia malayi	chromobox protein homolog 3	0.004	0.0324	0.3798
Loa Loa (eye worm)	hypothetical protein	0.0049	0.0427	0.4972
Trichomonas vaginalis	chromobox protein, putative	0.0072	0.0675	1
Echinococcus granulosus	neuropeptide s receptor	0.0491	0.5363	0.668
Schistosoma mansoni	cpg binding protein	0.0033	0.0248	0.0301
Giardia lamblia	Kinesin-5	0.0032	0.0235	0.5
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Loa Loa (eye worm)	hypothetical protein	0.0031	0.0227	0.2607
Echinococcus multilocularis	fetal alzheimer antigen, falz	0.0027	0.0176	0.017
Echinococcus granulosus	histone acetyltransferase MYST2	0.0061	0.0553	0.0682
Loa Loa (eye worm)	hypothetical protein	0.004	0.0324	0.3752
Schistosoma mansoni	tar DNA-binding protein	0.0065	0.0602	0.0743
Loa Loa (eye worm)	hypothetical protein	0.0061	0.0553	0.6471
Echinococcus multilocularis	suppression of tumorigenicity 18 protein	0.0061	0.0553	0.0548
Loa Loa (eye worm)	MBCTL1	0.0061	0.0553	0.6471
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0193	0.2789
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0087	0.0852	1
Schistosoma mansoni	tar DNA-binding protein	0.0065	0.0602	0.0743
Loa Loa (eye worm)	bromodomain containing protein	0.002	0.0096	0.1061
Schistosoma mansoni	tar DNA-binding protein	0.0065	0.0602	0.0743
Echinococcus multilocularis	lamin dm0	0.0059	0.0531	0.0525
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	0.5
Echinococcus granulosus	microtubule associated protein 2	0.0729	0.8026	1
Schistosoma mansoni	acetyl-CoA C-acetyltransferase	0.0027	0.0176	0.0211
Schistosoma mansoni	mixed-lineage leukemia protein mll	0.0063	0.0574	0.0708
Echinococcus multilocularis	ATP dependent Clp protease proteolytic subunit	0.0087	0.0852	0.0846
Echinococcus multilocularis	chromobox protein 1	0.0072	0.0675	0.0669
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.0087	0.0852	1
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.003	0.0212	0.2431
Loa Loa (eye worm)	intermediate filament tail domain-containing protein	0.0059	0.0531	0.6202
Echinococcus granulosus	chromobox protein 1	0.0072	0.0675	0.0834
Mycobacterium ulcerans	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	0.5
Echinococcus granulosus	fetal alzheimer antigen falz	0.0027	0.0176	0.0211
Echinococcus granulosus	SAM and MBT domain containing protein	0.0053	0.0471	0.058
Brugia malayi	Kinesin motor domain containing protein	0.0032	0.0235	0.2757
Loa Loa (eye worm)	intermediate filament protein	0.0059	0.0531	0.6202
Brugia malayi	RNA binding protein	0.0065	0.0602	0.707
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	0.5
Echinococcus granulosus	kinesin family 1	0.0247	0.2642	0.3286
Brugia malayi	M-phase phosphoprotein, mpp8	0.0012	0.0006	0.0074
Toxoplasma gondii	kinesin motor domain-containing protein	0.0032	0.0235	0.2703
Echinococcus granulosus	histone lysine methyltransferase setb	0.002	0.0096	0.0111
Toxoplasma gondii	ATP-dependent Clp endopeptidase, proteolytic subunit ClpP domain-containing protein	0.0087	0.0852	1
Echinococcus granulosus	chromodomain helicase DNA binding protein 4	0.0016	0.0049	0.0053
Schistosoma mansoni	peptidase Clp (S14 family)	0.0087	0.0852	0.1054
Echinococcus granulosus	zinc finger protein	0.0024	0.0139	0.0165
Schistosoma mansoni	zinc finger protein	0.0024	0.0139	0.0165
Loa Loa (eye worm)	TAR-binding protein	0.0065	0.0602	0.7048
Echinococcus multilocularis	chromodomain helicase DNA binding protein 4	0.0016	0.0049	0.0043
Brugia malayi	Associated with TFs and helicases family protein	0.0012	0.0006	0.0074
Schistosoma mansoni	sex comb on midleg homolog	0.0053	0.0471	0.058
Onchocerca volvulus		0.0012	0.0014	0.0137
Trypanosoma cruzi	ISWI complex protein	0.0017	0.0067	0.5
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.004	0.0324	0.605
Brugia malayi	Bromodomain containing protein	0.0043	0.0354	0.4152
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0019	0.0088	0.0102
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.002	0.0096	0.0111
Brugia malayi	C2-HC type zinc finger protein C.e-MyT1	0.0061	0.0553	0.6497
Echinococcus multilocularis	neuropeptide s receptor	0.0491	0.5363	0.536
Schistosoma mansoni	microtubule-associated protein tau	0.0729	0.8026	1
Schistosoma mansoni	hypothetical protein	0.0324	0.3496	0.4351
Onchocerca volvulus	Heterochromatin protein 1 homolog	0.0043	0.0358	0.6699
Echinococcus granulosus	cytoplasmic intermediate filament protein	0.0028	0.0192	0.0231
Echinococcus multilocularis	kinesin family 1	0.0247	0.2642	0.2637
Brugia malayi	mbt repeat family protein	0.0053	0.0471	0.553
Trichomonas vaginalis	conserved hypothetical protein	0.004	0.0324	0.4746
Entamoeba histolytica	kinesin, putative	0.0032	0.0235	1
Treponema pallidum	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	1
Schistosoma mansoni	histone-lysine n-methyltransferase setb1	0.002	0.0096	0.0111
Echinococcus multilocularis	peptidase Clp (S14 family)	0.0057	0.0516	0.0509
Loa Loa (eye worm)	heterochromatin protein 1	0.0072	0.0675	0.7906
Schistosoma mansoni	tar DNA-binding protein	0.0065	0.0602	0.0743
Echinococcus granulosus	neuropeptide receptor A26	0.0491	0.5363	0.668
Schistosoma mansoni	myelin transcription factor 1 myt1	0.0061	0.0553	0.0682
Brugia malayi	mbt repeat family protein	0.0053	0.0471	0.553
Trypanosoma brucei	ISWI complex protein	0.0017	0.0067	0.5
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 1 CLPP1 (ENDOPEPTIDASE CLP)	0.0057	0.0516	0.4744
Echinococcus multilocularis	histone lysine methyltransferase setb histone lysine methyltransferase eggless	0.002	0.0096	0.0089
Loa Loa (eye worm)	hypothetical protein	0.0079	0.0759	0.8896
Loa Loa (eye worm)	hypothetical protein	0.0027	0.018	0.2051
Echinococcus multilocularis	histone acetyltransferase MYST2	0.0061	0.0553	0.0548
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.0068	0.064	0.0634
Schistosoma mansoni	bromodomain containing protein	0.0072	0.0684	0.0846
Mycobacterium leprae	PROBABLE ATP-DEPENDENT CLP PROTEASE PROTEOLYTIC SUBUNIT 2 CLPP2 (ENDOPEPTIDASE CLP 2)	0.0087	0.0852	1
Echinococcus granulosus	peptidase Clp S14 family	0.0057	0.0516	0.0635
Echinococcus multilocularis	microtubule associated protein 2	0.0729	0.8026	0.8024
Loa Loa (eye worm)	CHromoDomain protein family member	0.0016	0.0049	0.0504
Brugia malayi	PHD-finger family protein	0.003	0.0205	0.241
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0047	0.04	0.4659
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0018	0.0081	0.1117
Onchocerca volvulus		0.0059	0.0531	1
Schistosoma mansoni	tar DNA-binding protein	0.0065	0.0602	0.0743
Brugia malayi	CXXC zinc finger family protein	0.0029	0.0205	0.2407
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0018	0.0081	0.1117
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Brugia malayi	Valyl-tRNA synthetase	0.0012	0.0006	0.0074
Echinococcus granulosus	chromobox protein 1	0.0072	0.0675	0.0834
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.04	0.0491
Onchocerca volvulus	Polycomb protein Sfmbt homolog	0.0053	0.0471	0.8862
Echinococcus granulosus	cpg binding protein	0.0033	0.0248	0.0301
Wolbachia endosymbiont of Brugia malayi	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	0.5
Schistosoma mansoni	scm-relatedprotein containing 4 mbt domains (sfmbt)	0.0053	0.0471	0.058
Chlamydia trachomatis	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	0.5
Echinococcus multilocularis	endonuclease exonuclease phosphatase	0.021	0.2222	0.2217
Echinococcus multilocularis	SAM and MBT domain containing protein	0.0053	0.0471	0.0465
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 1 ClpP1 (endopeptidase CLP)	0.0057	0.0516	0.5
Echinococcus granulosus	intermediate filament protein	0.0059	0.0531	0.0654
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0015	0.0041	0.0518
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Echinococcus granulosus	suppression of tumorigenicity 18 protein	0.0061	0.0553	0.0682
Toxoplasma gondii	histone lysine methyltransferase SET1	0.0058	0.0529	0.6185
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.04	0.0491
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Echinococcus multilocularis	cpg binding protein	0.0033	0.0248	0.0241
Echinococcus granulosus	endonuclease exonuclease phosphatase	0.021	0.2222	0.2763
Schistosoma mansoni	zinc finger protein	0.0017	0.0067	0.0075
Loa Loa (eye worm)	mbt repeat family protein	0.0053	0.0471	0.5496
Schistosoma mansoni	chromobox protein	0.0072	0.0675	0.0834
Loa Loa (eye worm)	hypothetical protein	0.002	0.0096	0.1056
Trichomonas vaginalis	chromodomain-helicase-DNA-binding protein, putative	0.0015	0.0046	0.0599
Trypanosoma cruzi	ISWI complex protein	0.0017	0.0067	0.5
Loa Loa (eye worm)	hypothetical protein	0.0043	0.0355	0.4118
Trichomonas vaginalis	conserved hypothetical protein	0.0028	0.0193	0.2789
Echinococcus granulosus	bromodomain adjacent to zinc finger domain	0.004	0.0324	0.0396
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0047	0.04	0.4699
Loa Loa (eye worm)	kinesin-like protein KLP2	0.0032	0.0235	0.2703
Schistosoma mansoni	hypothetical protein	0.0215	0.2282	0.2838
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.04	0.0491
Toxoplasma gondii	hypothetical protein	0.003	0.0212	0.2431
Echinococcus multilocularis	chromobox protein 1	0.0072	0.0675	0.0669
Echinococcus multilocularis	bromodomain adjacent to zinc finger domain	0.004	0.0324	0.0318
Echinococcus multilocularis	cytoplasmic intermediate filament protein	0.0028	0.0192	0.0185
Loa Loa (eye worm)	hypothetical protein	0.0087	0.0852	1
Loa Loa (eye worm)	PHD-finger family protein	0.0023	0.0133	0.1499
Schistosoma mansoni	cpg binding protein	0.0029	0.0205	0.0248
Schistosoma mansoni	lamin	0.0059	0.0531	0.0654
Mycobacterium tuberculosis	Probable ATP-dependent CLP protease proteolytic subunit 2 ClpP2 (endopeptidase CLP 2)	0.0057	0.0516	0.5
Loa Loa (eye worm)	RNA binding protein	0.0065	0.0602	0.7048
Brugia malayi	Heterochromatin protein 1	0.0072	0.0675	0.7922
Brugia malayi	CHD4 protein	0.0016	0.0049	0.0575
Brugia malayi	intermediate filament protein	0.0059	0.0531	0.623
Onchocerca volvulus		0.0031	0.0227	0.4204
Loa Loa (eye worm)	CXXC zinc finger family protein	0.0029	0.0205	0.235
Onchocerca volvulus		0.0053	0.0471	0.8862
Schistosoma mansoni	hypothetical protein	0.0023	0.0133	0.0158
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0047	0.04	0.0491
Schistosoma mansoni	lamin	0.0059	0.0531	0.0654
Echinococcus multilocularis	neuropeptide receptor A26	0.0491	0.5363	0.536
Echinococcus granulosus	polycomb protein SCMH1	0.0053	0.0471	0.058
Brugia malayi	Type III restriction enzyme, res subunit family protein	0.0012	0.0006	0.0074
Loa Loa (eye worm)	hypothetical protein	0.0053	0.0471	0.5496
Echinococcus granulosus	ATP dependent Clp protease proteolytic subunit	0.0087	0.0852	0.1054
Plasmodium vivax	ATP-dependent Clp protease proteolytic subunit, putative	0.003	0.0212	0.2431
Brugia malayi	TAR-binding protein	0.0065	0.0602	0.707
Trichomonas vaginalis	chromodomain helicase DNA binding protein, putative	0.0018	0.0081	0.1117
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.04	0.0394
Loa Loa (eye worm)	cytoplasmic intermediate filament protein	0.0031	0.0227	0.2604
Echinococcus granulosus	lamin dm0	0.0059	0.0531	0.0654
Loa Loa (eye worm)	hypothetical protein	0.0028	0.0192	0.2192
Trichomonas vaginalis	chromobox protein, putative	0.0072	0.0675	1
Brugia malayi	SET domain containing protein	0.0012	0.0014	0.0159
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0065	0.0602	0.7048
Schistosoma mansoni	histone-lysine n-methyltransferase suv9	0.0012	0.0014	0.0009
Brugia malayi	RNA recognition motif domain containing protein	0.0065	0.0602	0.707
Echinococcus granulosus	lamin	0.0059	0.0531	0.0654
Echinococcus granulosus	tar DNA binding protein	0.0065	0.0602	0.0743
Onchocerca volvulus		0.0029	0.0205	0.3789
Brugia malayi	Intermediate filament tail domain containing protein	0.0059	0.0531	0.623
Echinococcus multilocularis	methyl CpG binding domain protein 2	0.0019	0.0088	0.0082
Brugia malayi	Probable ClpP-like protease	0.0087	0.0852	1
Plasmodium falciparum	kinesin-5	0.0032	0.0235	0.2703
Echinococcus multilocularis	tar DNA binding protein	0.0065	0.0602	0.0596
Loa Loa (eye worm)	hypothetical protein	0.0046	0.0384	0.4468
Echinococcus granulosus	methyl CpG binding domain protein 2	0.0019	0.0088	0.0102
Plasmodium falciparum	ATP-dependent Clp protease proteolytic subunit	0.0087	0.0852	1
Brugia malayi	hypothetical protein	0.0012	0.0006	0.0074
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0047	0.04	0.0491
Schistosoma mansoni	chromodomain helicase DNA binding protein	0.0016	0.0049	0.0053
Echinococcus multilocularis	polycomb protein SCMH1	0.0053	0.0471	0.0465
Schistosoma mansoni	chromobox protein	0.0072	0.0675	0.0834
Echinococcus multilocularis	zinc finger protein	0.0024	0.0139	0.0132
Schistosoma mansoni	methyl-cpg binding protein mbd	0.0019	0.0088	0.0102
Schistosoma mansoni	cpg binding protein	0.0033	0.0248	0.0301
Plasmodium vivax	kinesin-5	0.0032	0.0235	0.2703
Onchocerca volvulus		0.0059	0.0531	1
Brugia malayi	cytoplasmic intermediate filament protein	0.0031	0.0227	0.2659
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0047	0.04	0.0394
Leishmania major	hypothetical protein, conserved	0.0017	0.0067	0.5
Echinococcus multilocularis	musashi	0.0059	0.0531	0.0525

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.15 uM	Inhibition of human recombinant C-terminal His6-tagged KSP ATPase activity after 1 hr by malachite green assay	ChEMBL.	21899292
IC50 (functional)	= 0.31 uM	Anticancer activity against human COLO205 cells after 72 hrs by MTS/PMS assay	ChEMBL.	21899292

Phenotypes

Whole-cell/tissue/organism interactions

Species name	Source	Reference	Is orphan
Homo sapiens	ChEMBL23	21899292

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

ChEMBL: CHEMBL1829400

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.

Detailed information for compound 1104486