TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 587.58 | Formula: C30H29N5O8
H donors: 0 H acceptors: 6 LogP: 4.26 Rotable bonds: 8
Rule of 5 violations (Lipinski): 2
SMILES: COc1cc(OC)c2c(c1)CCN1C2C2CCCC(N2C(=O)N(c2ccc(cc2)[N+](=O)[O-])c2ccc(cc2)[N+](=O)[O-])C1=O
InChi: 1S/C30H29N5O8/c1-42-23-16-18-14-15-31-28(27(18)26(17-23)43-2)24-4-3-5-25(29(31)36)33(24)30(37)32(19-6-10-21(11-7-19)34(38)39)20-8-12-22(13-9-20)35(40)41/h6-13,16-17,24-25,28H,3-5,14-15H2,1-2H3
InChiKey: HRGNDIHLYLURNE-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	FK506 binding protein 1A, 12kDa	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Leishmania braziliensis	fk506-binding protein 1-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma congolense	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	Get druggable targets OG5_126727	All targets in OG5_126727
Candida albicans	hypothetical protein	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma brucei gambiense	peptidylprolyl isomerase-like protein, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania infantum	peptidylprolyl isomerase-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma japonicum	FK506-binding protein 1A, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma congolense	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Loa Loa (eye worm)	hypothetical protein	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	Get druggable targets OG5_126727	All targets in OG5_126727
Loa Loa (eye worm)	FKBP5 protein	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma mansoni	immunophilin	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania mexicana	fk506-binding protein 1-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Candida albicans	one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma mansoni	immunophilin	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	Get druggable targets OG5_126727	All targets in OG5_126727
Trichomonas vaginalis	immunophilin, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	Get druggable targets OG5_126727	All targets in OG5_126727
Trichomonas vaginalis	fk506-binding protein, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Plasmodium knowlesi	peptidyl-prolyl cis-trans isomerase FKBP35, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	Get druggable targets OG5_126727	All targets in OG5_126727
Theileria parva	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania braziliensis	peptidylprolyl isomerase-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus multilocularis	fk506 binding protein	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania major	peptidylprolyl isomerase-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	Get druggable targets OG5_126727	All targets in OG5_126727
Candida albicans	one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania infantum	fk506-binding protein 1-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Neospora caninum	Peptidylprolyl isomerase D (Cyclophilin D), related	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma japonicum	ko:K09571 FK506-binding protein 4/5, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Candida albicans	one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes	Get druggable targets OG5_126727	All targets in OG5_126727
Trichomonas vaginalis	peptidylprolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania mexicana	peptidylprolyl isomerase-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma japonicum	ko:K09568 FK506-binding protein 1, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	Get druggable targets OG5_126727	All targets in OG5_126727
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	Get druggable targets OG5_126727	All targets in OG5_126727
Candida albicans	one of two identical potential FKBP-type peptidyl-prolyl cis-trans isomerase genes	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Plasmodium yoelii	FK506-binding protein	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania donovani	fk506-binding protein 1-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania major	fk506-binding protein 1-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Schistosoma mansoni	immunophilin	Get druggable targets OG5_126727	All targets in OG5_126727
Plasmodium berghei	peptidyl-prolyl cis-trans isomerase FKBP35, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Leishmania donovani	peptidylprolyl isomerase-like protein	Get druggable targets OG5_126727	All targets in OG5_126727
Trypanosoma brucei gambiense	peptidyl-prolyl cis-trans isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727
Trichomonas vaginalis	peptidylprolyl isomerase, putative	Get druggable targets OG5_126727	All targets in OG5_126727

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Trypanosoma brucei	macrophage infectivity potentiator, precursor, putative	FK506 binding protein 1A, 12kDa	108 aa	107 aa	48.6 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Schistosoma mansoni	endoplasmin	0.0032	0.0422	0.0572
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0032	0.042	0.0339
Trypanosoma brucei	Eukaryotic translation initiation factor 4E-1	0.0024	0.0173	0.0636
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Echinococcus multilocularis	eukaryotic translation initiation factor 4E	0.0024	0.0173	0.009
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.1164
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Brugia malayi	Corticotropin releasing factor receptor 2 precursor, putative	0.0035	0.051	0.0722
Echinococcus granulosus	heat shock protein	0.0032	0.0422	0.0341
Loa Loa (eye worm)	hypothetical protein	0.0085	0.2107	0.3423
Trichomonas vaginalis	carboxylesterase domain containing protein, putative	0.0035	0.0526	0.3551
Trichomonas vaginalis	heat shock protein, putative	0.0032	0.0422	0.2845
Loa Loa (eye worm)	RNA binding protein	0.0044	0.0807	0.1224
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-1	0.0024	0.0173	0.0636
Loa Loa (eye worm)	hypothetical protein	0.0035	0.051	0.0722
Brugia malayi	Carboxylesterase family protein	0.0207	0.5993	1
Schistosoma mansoni	hypothetical protein	0.0117	0.3138	0.5169
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Echinococcus granulosus	tar DNA binding protein	0.0044	0.0807	0.0729
Plasmodium falciparum	endoplasmin, putative	0.0023	0.0145	0.045
Trypanosoma brucei	heat shock protein 90, putative	0.0032	0.0422	0.2417
Echinococcus granulosus	heat shock protein 90	0.0027	0.0276	0.0194
Entamoeba histolytica	hypothetical protein	0.0025	0.0205	0.087
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-59, BmFKBP59	0.0065	0.1482	0.2366
Echinococcus granulosus	carboxylesterase 5A	0.0207	0.5993	0.596
Echinococcus multilocularis	neuropeptide s receptor	0.0334	1	1
Echinococcus granulosus	geminin	0.0117	0.3138	0.308
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0807	0.1224
Onchocerca volvulus	Huntingtin homolog	0.0085	0.2107	1
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.1164
Giardia lamblia	Heat shock protein HSP 90-alpha	0.0032	0.0422	0.1206
Loa Loa (eye worm)	carboxylesterase	0.0035	0.0526	0.0749
Echinococcus granulosus	neuroligin	0.0035	0.0526	0.0446
Onchocerca volvulus		0.0035	0.0526	0.2188
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Onchocerca volvulus		0.0035	0.0526	0.2188
Echinococcus granulosus	para nitrobenzyl esterase	0.0035	0.0526	0.0446
Leishmania major	eukaryotic translation initiation factor-like protein	0.0024	0.0173	0.0636
Schistosoma mansoni	BC026374 protein (S09 family)	0.0035	0.0526	0.0749
Trypanosoma cruzi	Eukaryotic translation initiation factor 4E-1	0.0024	0.0173	0.0636
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trichomonas vaginalis	heat shock protein, putative	0.0023	0.0145	0.0982
Schistosoma mansoni	immunophilin	0.0065	0.1482	0.2366
Brugia malayi	hypothetical protein	0.0035	0.0526	0.0749
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.0636
Trichomonas vaginalis	endoplasmin, putative	0.0023	0.0145	0.0982
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Echinococcus multilocularis	neuroligin	0.0035	0.0526	0.0446
Plasmodium vivax	heat shock protein 86, putative	0.0032	0.0422	0.1074
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.1164
Loa Loa (eye worm)	TAR-binding protein	0.0044	0.0807	0.1224
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Brugia malayi	RNA recognition motif domain containing protein	0.0044	0.0807	0.1224
Giardia lamblia	70 kDa peptidylprolyl isomerase, putative	0.0065	0.1482	1
Schistosoma mansoni	hypothetical protein	0.0033	0.0475	0.0662
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Leishmania major	peptidylprolyl isomerase-like protein	0.0065	0.1482	1
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type , putative	0.0065	0.1482	1
Onchocerca volvulus		0.0035	0.0526	0.2188
Mycobacterium ulcerans	carboxylesterase, LipT	0.0035	0.0526	0.1484
Brugia malayi	RNA binding protein	0.0044	0.0807	0.1224
Schistosoma mansoni	hypothetical protein	0.0024	0.0164	0.0135
Loa Loa (eye worm)	carboxylesterase	0.0207	0.5993	1
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0056	0.1197	0.1123
Echinococcus multilocularis	endoplasmin	0.003	0.036	0.0278
Mycobacterium leprae	PROBABLE CHAPERONE PROTEIN HTPG (HEAT SHOCK PROTEIN) (HSP90 FAMILY PROTEIN) (HIGH TEMPERATURE PROTEIN G)	0.003	0.036	0.5
Brugia malayi	TAR-binding protein	0.0044	0.0807	0.1224
Loa Loa (eye worm)	FKBP-type peptidyl-prolyl cis-trans isomerase-12	0.0065	0.1482	0.2366
Loa Loa (eye worm)	endoplasmin	0.0032	0.0422	0.0572
Schistosoma mansoni	transcription factor LCR-F1	0.0025	0.0205	0.0206
Trypanosoma cruzi	heat shock protein 90, putative	0.0032	0.0422	0.2417
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0044	0.0807	0.1224
Toxoplasma gondii	heat shock protein 90, putative	0.0032	0.0422	0.1074
Schistosoma mansoni	hypothetical protein	0.0117	0.3138	0.5169
Onchocerca volvulus		0.0035	0.0526	0.2188
Schistosoma mansoni	immunophilin	0.0065	0.1482	0.2366
Trichomonas vaginalis	heat shock protein, putative	0.003	0.036	0.2427
Onchocerca volvulus		0.0033	0.0475	0.1932
Toxoplasma gondii	heat shock protein HSP90	0.0032	0.0422	0.1074
Brugia malayi	translation initiation factor 4E	0.0024	0.0173	0.0151
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Schistosoma mansoni	survival motor neuron protein	0.0033	0.0475	0.0662
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0032	0.042	0.0569
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0807	0.1224
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1482	1
Loa Loa (eye worm)	hypothetical protein	0.0207	0.5993	1
Brugia malayi	latrophilin 2 splice variant baaae	0.0024	0.0164	0.0135
Echinococcus granulosus	eukaryotic translation initiation factor 4E	0.0024	0.0173	0.009
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0032	0.042	0.0569
Echinococcus multilocularis	BC026374 protein (S09 family)	0.0035	0.0526	0.0446
Entamoeba histolytica	heat shock protein 90, putative	0.0032	0.0422	0.2417
Loa Loa (eye worm)	hypothetical protein	0.0085	0.2107	0.3423
Echinococcus multilocularis	survival motor neuron protein 1	0.0164	0.4611	0.4566
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Echinococcus multilocularis	para nitrobenzyl esterase	0.0035	0.0526	0.0446
Trichomonas vaginalis	heat shock protein, putative	0.003	0.036	0.2427
Trypanosoma brucei	heat shock protein 90, putative	0.0032	0.0422	0.2417
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0065	0.1482	0.141
Entamoeba histolytica	heat shock protein 90, putative	0.0032	0.0422	0.2417
Entamoeba histolytica	peptidyl-prolyl cis-trans isomerase, FKBP-type, putative	0.0065	0.1482	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0526	0.0749
Entamoeba histolytica	hypothetical protein	0.0025	0.0205	0.087
Loa Loa (eye worm)	pigment dispersing factor receptor c	0.0035	0.051	0.0722
Loa Loa (eye worm)	carboxylesterase	0.0035	0.0526	0.0749
Entamoeba histolytica	hypothetical protein	0.0025	0.0205	0.087
Trichomonas vaginalis	fk506-binding protein, putative	0.0065	0.1482	1
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Brugia malayi	Carboxylesterase family protein	0.0035	0.0526	0.0749
Schistosoma mansoni	heat shock protein	0.0032	0.0422	0.0572
Echinococcus multilocularis	geminin	0.0117	0.3138	0.308
Echinococcus multilocularis	family S9 non peptidase ue (S09 family)	0.0035	0.0526	0.0446
Trichomonas vaginalis	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.1164
Schistosoma mansoni	hypothetical protein	0.0025	0.0205	0.0206
Echinococcus multilocularis	tar DNA binding protein	0.0044	0.0807	0.0729
Echinococcus granulosus	acetylcholinesterase	0.0207	0.5993	0.596
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1482	1
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0526	1
Schistosoma mansoni	hypothetical protein	0.02	0.5746	0.9581
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Treponema pallidum	peptidyl-prolyl cis-trans isomerase, FKBP-type, 22 kDa (fklB)	0.0065	0.1482	1
Trypanosoma brucei	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1482	1
Giardia lamblia	Grp94/Hsp90	0.003	0.036	0.0693
Echinococcus multilocularis	peptidyl prolyl cis trans isomerase FKBP4	0.0065	0.1482	0.141
Echinococcus granulosus	heat shock protein heat shock protein 90 alpha	0.0027	0.0276	0.0194
Echinococcus granulosus	BC026374 protein S09 family	0.0035	0.0526	0.0446
Schistosoma mansoni	immunophilin	0.0056	0.1197	0.1885
Echinococcus granulosus	Basic leucine zipper bZIP transcription	0.0025	0.0205	0.0123
Echinococcus multilocularis	heat shock protein 90	0.0027	0.0276	0.0194
Echinococcus multilocularis	heat shock protein 90	0.0032	0.0422	0.0341
Plasmodium vivax	endoplasmin, putative	0.0032	0.0422	0.1074
Brugia malayi	hypothetical protein	0.0085	0.2107	0.3423
Giardia lamblia	FKBP-type peptidyl-prolyl cis-trans isomerase	0.0065	0.1482	1
Loa Loa (eye worm)	acetylcholinesterase 1	0.0207	0.5993	1
Trypanosoma cruzi	heat shock protein 85, putative	0.0027	0.0276	0.1377
Schistosoma mansoni	heat shock protein	0.0032	0.0422	0.0572
Leishmania major	eukaryotic translation initiation factor-like	0.0024	0.0173	0.0636
Schistosoma mansoni	Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein)	0.0032	0.042	0.0569
Echinococcus multilocularis	Basic leucine zipper (bZIP) transcription	0.0025	0.0205	0.0123
Schistosoma mansoni	immunophilin FK506 binding protein FKBP12	0.0065	0.1482	0.2366
Brugia malayi	Iron-sulfur cluster assembly accessory protein	0.0033	0.0475	0.0662
Brugia malayi	Endoplasmin precursor	0.0032	0.0422	0.0572
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Schistosoma mansoni	acetylcholinesterase	0.0035	0.0526	0.0749
Echinococcus granulosus	endoplasmin	0.003	0.036	0.0278
Trypanosoma cruzi	Heat shock protein 83, putative	0.0032	0.0422	0.2417
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Trypanosoma brucei	Heat shock protein 83, putative	0.0032	0.0422	0.2417
Trypanosoma cruzi	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1482	1
Echinococcus multilocularis	fk506 binding protein	0.0065	0.1482	0.141
Echinococcus multilocularis	X box binding protein 1	0.02	0.5746	0.571
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0065	0.1482	1
Echinococcus multilocularis	carboxylesterase 5A	0.0207	0.5993	0.596
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Leishmania major	eukaryotic translation initiation factor eIF-4E, putative	0.0024	0.0173	0.0636
Toxoplasma gondii	Hsp90 domain-containing protein	0.012	0.3231	1
Loa Loa (eye worm)	hypothetical protein	0.0056	0.1197	0.1885
Brugia malayi	hypothetical protein	0.0164	0.4611	0.7661
Echinococcus multilocularis	heat shock protein	0.0032	0.0422	0.0341
Loa Loa (eye worm)	FKBP5 protein	0.0065	0.1482	0.2366
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Mycobacterium ulcerans	FK-506 binding protein, peptidyl-prolyl cis-trans isomerase	0.0065	0.1482	1
Brugia malayi	Carboxylesterase family protein	0.0035	0.0526	0.0749
Echinococcus granulosus	acetylcholinesterase	0.0207	0.5993	0.596
Echinococcus multilocularis	neuropeptide receptor A26	0.0334	1	1
Brugia malayi	hypothetical protein	0.0025	0.0205	0.0206
Echinococcus granulosus	guanine nucleotide binding protein Gs subunit	0.0032	0.042	0.0339
Trypanosoma cruzi	heat shock protein 85, putative	0.0032	0.0422	0.2417
Schistosoma mansoni	gliotactin	0.0035	0.0526	0.0749
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0807	0.1224
Trypanosoma cruzi	FK506-binding protein (FKBP)-type peptidyl-prolyl isomerase, putative	0.0065	0.1482	1
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Trichomonas vaginalis	immunophilin, putative	0.0065	0.1482	1
Loa Loa (eye worm)	heat shock protein 90	0.0032	0.0422	0.0572
Leishmania major	lipophosphoglycan biosynthetic protein, putative,heat shock protein 90, putative,glucose regulated protein 94, putative	0.003	0.036	0.1975
Onchocerca volvulus		0.0035	0.0526	0.2188
Echinococcus granulosus	heat shock protein 90	0.0032	0.0422	0.0341
Echinococcus multilocularis	acetylcholinesterase	0.0207	0.5993	0.596
Leishmania major	heat shock protein 83-1	0.0032	0.0422	0.2417
Plasmodium falciparum	heat shock protein 90	0.0032	0.0422	0.1305
Onchocerca volvulus	Huntingtin homolog	0.0085	0.2107	1
Entamoeba histolytica	hypothetical protein	0.0025	0.0205	0.087
Schistosoma mansoni	eukaryotic translation initiation factor 4e	0.0024	0.0173	0.0151
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP1A	0.0065	0.1482	0.141
Brugia malayi	FKBP-type peptidyl-prolyl cis-trans isomerase-12, BmFKBP-12	0.0065	0.1482	0.2366
Mycobacterium tuberculosis	POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT)	0.0035	0.0526	1
Loa Loa (eye worm)	GTP-binding regulatory protein Gs alpha-S chain	0.0032	0.042	0.0569
Loa Loa (eye worm)	translation initiation factor 4E	0.0024	0.0173	0.0151
Brugia malayi	Carboxylesterase family protein	0.0035	0.0526	0.0749
Loa Loa (eye worm)	hypothetical protein	0.0024	0.0164	0.0135
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Trichomonas vaginalis	peptidylprolyl isomerase, putative	0.0065	0.1482	1
Plasmodium vivax	70 kDa peptidylprolyl isomerase, putative	0.0065	0.1482	0.4443
Brugia malayi	Calcitonin receptor-like protein seb-1	0.0035	0.051	0.0722
Echinococcus multilocularis	acetylcholinesterase	0.0207	0.5993	0.596
Echinococcus granulosus	X box binding protein 1	0.02	0.5746	0.571
Plasmodium vivax	heat shock protein, putative	0.012	0.3231	1
Brugia malayi	heat shock protein 90	0.0032	0.0422	0.0572
Echinococcus granulosus	neuropeptide receptor A26	0.0334	1	1
Wolbachia endosymbiont of Brugia malayi	heat shock protein 90	0.003	0.036	0.5
Loa Loa (eye worm)	hypothetical protein	0.0164	0.4611	0.7661
Schistosoma mansoni	neuroligin 3 (S09 family)	0.0035	0.0526	0.0749
Brugia malayi	GTP-binding regulatory protein Gs alpha-S chain, putative	0.0032	0.042	0.0569
Loa Loa (eye worm)	hypothetical protein	0.0035	0.0526	0.0749
Brugia malayi	Carboxylesterase family protein	0.0035	0.0526	0.0749
Trypanosoma brucei	peptidyl-prolyl cis-trans isomerase, putative	0.0065	0.1482	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0526	0.0749
Leishmania major	fk506-binding protein 1-like protein	0.0065	0.1482	1
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0207	0.5993	1
Plasmodium falciparum	peptidyl-prolyl cis-trans isomerase FKBP35	0.0065	0.1482	0.4587
Echinococcus granulosus	family S9 non peptidase ue S09 family	0.0035	0.0526	0.0446
Mycobacterium tuberculosis	Carboxylesterase LipT	0.0035	0.0526	1
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0807	0.1224
Trypanosoma brucei	heat shock protein, putative	0.0032	0.0422	0.2417
Echinococcus granulosus	survival motor neuron protein 1	0.0164	0.4611	0.4566
Trichomonas vaginalis	spcc417.12 protein, putative	0.0035	0.0526	0.3551
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0032	0.042	0.0339
Echinococcus multilocularis	guanine nucleotide binding protein G(s) subunit	0.0032	0.042	0.0339
Schistosoma mansoni	family S9 non-peptidase homologue (S09 family)	0.0035	0.0526	0.0749
Plasmodium falciparum	heat shock protein 90, putative	0.012	0.3231	1
Trypanosoma cruzi	heat shock protein 85, putative	0.0032	0.0422	0.2417
Toxoplasma gondii	eukaryotic initiation factor-4E, putative	0.0024	0.0173	0.0283
Trypanosoma cruzi	heat shock protein 90, putative	0.0027	0.0276	0.1377
Loa Loa (eye worm)	hypothetical protein	0.0207	0.5993	1
Trypanosoma cruzi	heat shock protein 85, putative	0.0032	0.0422	0.2417
Entamoeba histolytica	eukaryotic translation initiation factor 4E, putative	0.0024	0.0173	0.0636
Trichomonas vaginalis	heat shock protein, putative	0.0027	0.0276	0.1863
Echinococcus granulosus	peptidyl prolyl cis trans isomerase FKBP4	0.0056	0.1197	0.1123
Schistosoma mansoni	tar DNA-binding protein	0.0044	0.0807	0.1224
Schistosoma mansoni	endoplasmin	0.0032	0.0422	0.0572
Brugia malayi	Carboxylesterase family protein	0.0207	0.5993	1

Activities

Activity type	Activity value	Assay description	Source	Reference
Ki (binding)	= 772 nM	Inhibition of FKBP12 rotamase activity	ChEMBL.	16451085
Ki (binding)	= 772 nM	Inhibition of FKBP12 rotamase activity	ChEMBL.	16451085

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.

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External resources for this compound

No external resources registered for this compound

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 352552