TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 522.532 | Formula: C27H30F4N2O4
H donors: 2 H acceptors: 3 LogP: 4.83 Rotable bonds: 10
Rule of 5 violations (Lipinski): 2
SMILES: NC(=O)OC[C@@]1(CC[C@@H](CC1)N(C(=O)c1ccc(cc1)[C@@](C(F)(F)F)(O)C)C1CC1)c1ccc(cc1)F
InChi: 1S/C27H30F4N2O4/c1-25(36,27(29,30)31)18-4-2-17(3-5-18)23(34)33(21-10-11-21)22-12-14-26(15-13-22,16-37-24(32)35)19-6-8-20(28)9-7-19/h2-9,21-22,36H,10-16H2,1H3,(H2,32,35)/t22-,25-,26-/m0/s1
InChiKey: YBEVGNPGCWXRME-HRNNMHKYSA-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	hydroxysteroid (11-beta) dehydrogenase 1	Starlite/ChEMBL	References

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Mycobacterium ulcerans	short chain dehydrogenase	Get druggable targets OG5_132866	All targets in OG5_132866
Mycobacterium tuberculosis	Probable oxidoreductase	Get druggable targets OG5_132866	All targets in OG5_132866

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Plasmodium falciparum	steroid dehydrogenase, putative	hydroxysteroid (11-beta) dehydrogenase 1	292 aa	250 aa	24.8 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Brugia malayi	serine/threonine-protein kinase plk-2	0.0109	0.0042	0.0509
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0515	0.03	0.3686
Brugia malayi	Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog	0.008	0.0024	0.0288
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.0758	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.04	0.0227	0.2734
Entamoeba histolytica	phosphatidylinositol 3-kinase 3, putative	0.0265	0.0141	0.1305
Leishmania major	target of rapamycin kinase (TOR) kinase 3	0.1285	0.0789	0.217
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0448	0.0258	0.3155
Trypanosoma cruzi	target of rapamycin kinase 3	0.1285	0.0789	0.2275
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0515	0.03	0.3617
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0758	0.0455	0.5632
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0358	0.02	0.02
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.1117	0.0682	0.8498
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0285	0.0154	0.1846
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.1117	0.0682	0.1968
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0737	0.0441	0.546
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.0758	0.0455	0.0823
Entamoeba histolytica	protein kinase rad3, putative	0.0713	0.0426	0.5056
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0265	0.0141	0.0141
Echinococcus multilocularis	Zinc finger, PHD finger	0.0376	0.0212	0.0212
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0265	0.0141	0.1799
Brugia malayi	Cytochrome P450 family protein	0.0134	0.0058	0.0699
Schistosoma mansoni	phosphatidylinositol 3-and 4-kinase	0.1349	0.083	0.1503
Echinococcus multilocularis	nuclear receptor nhr 48	0.0358	0.02	0.02
Onchocerca volvulus		0.0265	0.0141	0.2404
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0515	0.03	0.3686
Brugia malayi	Nuclear hormone receptor E75	0.0358	0.02	0.2412
Schistosoma mansoni	RAR-like nuclear receptor	0.0758	0.0455	0.0823
Brugia malayi	nuclear receptor RXR	0.04	0.0227	0.2741
Brugia malayi	phosphatidylinositol 4-kinase, catalytic, alpha polypeptide	0.0376	0.0212	0.2554
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.0758	0.0455	0.0823
Echinococcus multilocularis	tar DNA binding protein	0.0073	0.0019	0.0019
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0376	0.0212	0.0384
Schistosoma mansoni	tar DNA-binding protein	0.0073	0.0019	0.0035
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.1117	0.0682	0.8429
Echinococcus granulosus	phosphatidylinositol 3 and 4 kinase	0.1349	0.083	0.083
Schistosoma mansoni	serine/threonine protein kinase	0.0109	0.0042	0.0077
Trichomonas vaginalis	conserved hypothetical protein	0.0448	0.0258	0.3155
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Trypanosoma brucei	target of rapamycin kinase 3, putative	0.1285	0.0789	0.9843
Entamoeba histolytica	FKBP-rapamycin associated protein (FRAP), putative	0.1304	0.0802	1
Echinococcus granulosus	serine:threonine protein kinase SMG1	0.0713	0.0426	0.0426
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Onchocerca volvulus		0.0758	0.0455	1
Giardia lamblia	Hypothetical protein	0.0265	0.0141	0.1305
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.0758	0.0455	0.0455
Trichomonas vaginalis	conserved hypothetical protein	0.0526	0.0307	0.3777
Onchocerca volvulus		0.0358	0.02	0.3831
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0745	0.0446	0.1287
Leishmania major	target of rapamycin (TOR) kinase 2, putative	0.1304	0.0802	0.2205
Entamoeba histolytica	hypothetical protein	0.0745	0.0446	0.5322
Brugia malayi	nuclear hormone receptor family member odr-7	0.0358	0.02	0.2412
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0358	0.02	0.3831
Echinococcus granulosus	phosphatidylinositol 4 kinase alpha	0.0376	0.0212	0.0212
Brugia malayi	tailless protein	0.0358	0.02	0.2412
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0265	0.0141	0.0408
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.0758	0.0455	0.5464
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0075	0.0021	0.0166
Echinococcus granulosus	serine:threonine protein kinase PLK1	0.0109	0.0042	0.0042
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0376	0.0212	0.2697
Loa Loa (eye worm)	phosphatidylinositol 3	0.0265	0.0141	0.1699
Brugia malayi	TAR-binding protein	0.0073	0.0019	0.0235
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1117	0.0682	0.8223
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0758	0.0455	0.5477
Leishmania major	cytochrome p450-like protein	0.0063	0.0013	0.0037
Leishmania major	protein kinase, putative,polo-like protein kinase, putative	0.0109	0.0042	0.0116
Mycobacterium ulcerans	short chain dehydrogenase	0.0338	0.0188	1
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0753	0.0452	0.5592
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0358	0.02	0.02
Loa Loa (eye worm)	phosphatidylinositol 3	0.0265	0.0141	0.1699
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0778	0.0467	0.5792
Onchocerca volvulus		0.0265	0.0141	0.2404
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1259	0.0773	0.9641
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Echinococcus multilocularis	serine:threonine protein kinase SMG1	0.0713	0.0426	0.0426
Leishmania major	phosphatidylinositol kinase related protein, putative	0.0297	0.0162	0.0444
Brugia malayi	Nuclear hormone receptor-like 1	0.04	0.0227	0.2741
Echinococcus granulosus	muscleblind protein	0.0344	0.0192	0.0192
Brugia malayi	FAT domain containing protein	0.0526	0.0307	0.3704
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Loa Loa (eye worm)	phosphatidylinositol 3	0.1304	0.0802	0.9638
Loa Loa (eye worm)	hypothetical protein	0.0526	0.0307	0.3695
Entamoeba histolytica	phosphatidylinositol 3-kinase 1, putative	0.0852	0.0514	0.6213
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0758	0.0455	0.5477
Schistosoma mansoni	voltage-gated potassium channel	0.0087	0.0029	0.0052
Loa Loa (eye worm)	nuclear hormone receptor	0.0358	0.02	0.2407
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.0758	0.0455	0.5464
Loa Loa (eye worm)	hypothetical protein	0.0389	0.022	0.2647
Giardia lamblia	GTOR	0.1304	0.0802	1
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.0758	0.0455	0.5464
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.0758	0.0455	0.5477
Leishmania major	phosphatidylinositol kinase, putative	0.0265	0.0141	0.0389
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0758	0.0455	0.0455
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0265	0.0141	0.1799
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0753	0.0452	0.5592
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0904	0.0547	0.6796
Echinococcus granulosus	phosphatidylinositol 4 phosphate 3 kinase C2	0.0728	0.0435	0.0435
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.0758	0.0455	0.0455
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0758	0.0455	0.5477
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.1491	0.092	0.1666
Echinococcus granulosus	serine protein kinase ATM	0.0745	0.0446	0.0446
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0265	0.0141	0.1687
Loa Loa (eye worm)	hypothetical protein	0.0791	0.0476	0.5718
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0358	0.02	0.3831
Trypanosoma cruzi	phosphatidylinositol 3-kinase vps34-like	0.0515	0.03	0.0865
Brugia malayi	Nuclear hormone receptor E75	0.0358	0.02	0.2412
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1259	0.0773	0.9641
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.0758	0.0455	0.5477
Loa Loa (eye worm)	pre-SET domain-containing protein family protein	0.024	0.0126	0.1509
Brugia malayi	orphan nuclear receptor NR2E1	0.0358	0.02	0.2412
Schistosoma mansoni	ataxia telangiectasia mutated (atm)-related	0.1304	0.0802	0.1452
Loa Loa (eye worm)	CYP4Cod1	0.0063	0.0013	0.016
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.0758	0.0455	0.0455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1265	0.0776	0.9682
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.0358	0.02	0.2407
Brugia malayi	ecdysteroid receptor	0.0758	0.0455	0.5477
Brugia malayi	nuclear receptor NHR-67	0.0358	0.02	0.2412
Brugia malayi	hypothetical protein	0.0358	0.02	0.2412
Trichomonas vaginalis	PIKK family atypical protein kinase	0.126	0.0773	0.9642
Brugia malayi	nuclear receptor NHR-88	0.0758	0.0455	0.5477
Echinococcus multilocularis	phosphatidylinositol 4,5 bisphosphate 3 kinase	0.1491	0.092	0.092
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0358	0.02	0.2407
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Brugia malayi	Cytochrome P450 family protein	0.0063	0.0013	0.0161
Leishmania major	hypothetical protein, conserved	0.5766	0.3636	1
Trypanosoma cruzi	cytochrome P450, putative	0.0063	0.0013	0.0038
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0265	0.0141	0.1704
Trypanosoma brucei	polo-like protein kinase	0.0109	0.0042	0.0527
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.048	0.0278	0.0802
Loa Loa (eye worm)	RNA binding protein	0.0073	0.0019	0.0234
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0758	0.0455	0.0455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0745	0.0446	0.5528
Trypanosoma brucei	phosphatidylinositol 4-kinase alpha, putative	0.0376	0.0212	0.2644
Loa Loa (eye worm)	hypothetical protein	0.04	0.0227	0.2734
Brugia malayi	steroid hormone receptor	0.0758	0.0455	0.5477
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1284	0.0789	0.9841
Brugia malayi	Muscleblind-like protein	0.0344	0.0192	0.2313
Trypanosoma cruzi	phosphatidylinositol kinase, putative	0.0265	0.0141	0.0408
Brugia malayi	ecdysone receptor	0.0358	0.02	0.2412
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1259	0.0773	0.9641
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0753	0.0452	0.5592
Leishmania major	target of rapamycin (TOR) kinase 1, putative	0.1304	0.0802	0.2205
Leishmania major	phosphatidylinositol 3-kinase, putative	0.124	0.0761	0.2092
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.0758	0.0455	0.5477
Loa Loa (eye worm)	DR-78	0.0358	0.02	0.2407
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.0758	0.0455	0.0455
Trypanosoma brucei	phosphatidylinositol 3-related kinase, putative	0.1263	0.0775	0.9671
Echinococcus granulosus	phosphatidylinositol 3 kinase catalytic subunit	0.0376	0.0212	0.0212
Leishmania major	phosphatidylinositol 3-related kinase, putative	0.1263	0.0775	0.2132
Brugia malayi	hypothetical protein	0.0358	0.02	0.2412
Brugia malayi	Cytochrome P450 family protein	0.0063	0.0013	0.0161
Loa Loa (eye worm)	hypothetical protein	0.0344	0.0192	0.2307
Trypanosoma cruzi	polo-like protein kinase, putative	0.0109	0.0042	0.0122
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.0758	0.0455	0.5464
Entamoeba histolytica	phosphatidylinositol 4-kinase, putative	0.0376	0.0212	0.2234
Echinococcus multilocularis	DNA dependent protein kinase catalytic subunit	1.5784	1	1
Echinococcus multilocularis	muscleblind protein	0.0344	0.0192	0.0192
Loa Loa (eye worm)	hypothetical protein	0.04	0.0227	0.2734
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1284	0.0789	0.9841
Echinococcus granulosus	Phosphatidylinositol 4 kinase type 2 beta	0.0265	0.0141	0.0141
Trichomonas vaginalis	PIKK family atypical protein kinase	0.126	0.0773	0.9642
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.04	0.0227	0.2734
Loa Loa (eye worm)	phosphatidylinositol 3	0.025	0.0132	0.1585
Schistosoma mansoni	tar DNA-binding protein	0.0073	0.0019	0.0035
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Echinococcus multilocularis	FKBP12 rapamycin complex associated protein	0.1304	0.0802	0.0802
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.0758	0.0455	0.5477
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.04	0.0227	0.0412
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.0515	0.03	0.3744
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Loa Loa (eye worm)	hypothetical protein	0.0344	0.0192	0.2307
Brugia malayi	conserved hypotetical protein	0.0358	0.02	0.2412
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.0758	0.0455	0.5464
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor1	0.1304	0.0802	0.2312
Mycobacterium leprae	conserved hypothetical protein	0.0265	0.0141	1
Entamoeba histolytica	hypothetical protein	0.0265	0.0141	0.1305
Schistosoma mansoni	fkbp-rapamycin associated protein	0.0713	0.0426	0.0772
Toxoplasma gondii	non-specific serine/threonine protein kinase	0.0791	0.0476	0.6053
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1304	0.0802	0.9661
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.0713	0.0426	0.1229
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.0758	0.0455	0.0455
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0515	0.03	0.3686
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0358	0.02	0.2412
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0376	0.0212	0.2576
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.0758	0.0455	0.5464
Echinococcus multilocularis	FTZ F1 alpha	0.0758	0.0455	0.0455
Trypanosoma brucei	Phosphatidylinositol 3-kinase tor1	0.1304	0.0802	1
Schistosoma mansoni	tar DNA-binding protein	0.0073	0.0019	0.0035
Giardia lamblia	Phosphoinositide-3-kinase, class 3	0.0404	0.023	0.2466
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0265	0.0141	0.1704
Schistosoma mansoni	hypothetical protein	0.0526	0.0307	0.0557
Loa Loa (eye worm)	phosphatidylinositol 4-kinase type 3 alpha isoform 1	0.0376	0.0212	0.2548
Trypanosoma cruzi	Phosphatidylinositol 3-kinase tor2	0.1304	0.0802	0.2312
Loa Loa (eye worm)	hypothetical protein	0.0265	0.0141	0.1699
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Schistosoma mansoni	steroid hormone receptor ad4bp	0.0758	0.0455	0.0823
Mycobacterium tuberculosis	Conserved hypothetical protein	0.0265	0.0141	0.7527
Loa Loa (eye worm)	cytochrome P450 family protein	0.0134	0.0058	0.0698
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0265	0.0141	0.1687
Brugia malayi	hypothetical protein	0.04	0.0227	0.2741
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.1349	0.083	1
Schistosoma mansoni	voltage-gated potassium channel	0.0087	0.0029	0.0052
Onchocerca volvulus		0.0273	0.0147	0.253
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Schistosoma mansoni	phosphatidylinositol 4-kinase type-II	0.0265	0.0141	0.0256
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Loa Loa (eye worm)	hypothetical protein	0.0728	0.0435	0.5233
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Onchocerca volvulus		0.0358	0.02	0.3831
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1349	0.083	0.2393
Giardia lamblia	Phosphatidylinositol 4-kinase	0.0265	0.0141	0.1305
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0713	0.0426	0.5274
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.0758	0.0455	0.0823
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0265	0.0141	0.1799
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0978	0.0594	0.7268
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.0265	0.0141	0.1763
Echinococcus multilocularis	phosphatidylinositol 4 kinase alpha	0.0376	0.0212	0.0212
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Entamoeba histolytica	phosphatidylinositol3-kinaseTor2, putative	0.1304	0.0802	1
Loa Loa (eye worm)	RNA recognition domain-containing protein domain-containing protein	0.0073	0.0019	0.0234
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1284	0.0789	0.9841
Echinococcus multilocularis	serine protein kinase ATM	0.0745	0.0446	0.0446
Loa Loa (eye worm)	phosphatidylinositol kinase	0.0265	0.0141	0.1699
Loa Loa (eye worm)	phosphatidylinositol 3	0.0265	0.0141	0.1699
Schistosoma mansoni	nuclear hormone receptor	0.0758	0.0455	0.0823
Echinococcus multilocularis	ecdysone induced protein 78C	0.0758	0.0455	0.0455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1263	0.0775	0.9668
Entamoeba histolytica	Phosphatidylinositol 3- and 4-kinase family	0.0737	0.0441	0.5251
Echinococcus multilocularis	phosphatidylinositol 3 and 4 kinase	0.1349	0.083	0.083
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Trichomonas vaginalis	set domain proteins, putative	0.0273	0.0147	0.1753
Trypanosoma brucei	phosphatidylinositol 3-kinase catalytic subunit, putative	0.0265	0.0141	0.1763
Trypanosoma brucei	cytochrome P450, putative	0.0063	0.0013	0.0166
Schistosoma mansoni	coup transcription factor	0.0758	0.0455	0.0823
Onchocerca volvulus	Bile acid receptor homolog	0.0758	0.0455	1
Brugia malayi	phosphoinositide 3'-hydroxykinase p110-alpha subunit, putative	0.0374	0.0211	0.2539
Schistosoma mansoni	nuclear receptor nhr-48	0.0358	0.02	0.0362
Trichomonas vaginalis	PIKK family atypical protein kinase	0.124	0.0761	0.9482
Trypanosoma cruzi	phosphatidylinositol 3-related kinase, putative	0.1349	0.083	0.2393
Schistosoma mansoni	nuclear receptor	0.0358	0.02	0.0362
Echinococcus multilocularis	muscleblind protein 1	0.0344	0.0192	0.0192
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0265	0.0141	0.1704
Loa Loa (eye worm)	PLK/PLK1 protein kinase	0.0109	0.0042	0.0508
Schistosoma mansoni	ataxia telangiectasia mutated (atm)	0.0745	0.0446	0.0808
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0265	0.0141	0.0141
Schistosoma mansoni	kinase	0.0055	0.0008	0.0015
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0376	0.0212	0.0611
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0728	0.0435	0.5245
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1265	0.0776	0.9682
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Trichomonas vaginalis	PIKK family atypical protein kinase	0.124	0.0761	0.9482
Onchocerca volvulus	Protein ultraspiracle homolog	0.0758	0.0455	1
Echinococcus granulosus	tar DNA binding protein	0.0073	0.0019	0.0019
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.0758	0.0455	0.5477
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0758	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.8736	0.5523	1
Schistosoma mansoni	zinc finger protein	0.0358	0.02	0.0362
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0589	0.0347	0.4014
Trypanosoma brucei	phosphatidylinositol 3-kinase, putative	0.124	0.0761	0.9487
Trypanosoma brucei	phosphatidylinositol 3-kinase tor, putative	0.0305	0.0167	0.2079
Schistosoma mansoni	tar DNA-binding protein	0.0073	0.0019	0.0035
Trypanosoma brucei	FAT domain/Rapamycin binding domain/Phosphatidylinositol 3- and 4-kinase, putative	0.0811	0.0488	0.6091
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0515	0.03	0.0543
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0515	0.03	0.3395
Echinococcus granulosus	thyroid hormone receptor alpha	0.0358	0.02	0.02
Toxoplasma gondii	FATC domain-containing protein	0.0745	0.0446	0.5681
Loa Loa (eye worm)	phosphatidylinositol 3	0.1352	0.0832	1
Schistosoma mansoni	hypothetical protein	0.0265	0.0141	0.0256
Brugia malayi	Pre-SET motif family protein	0.024	0.0126	0.1513
Echinococcus granulosus	ecdysone induced protein 78C	0.0758	0.0455	0.0455
Loa Loa (eye worm)	TAR-binding protein	0.0073	0.0019	0.0234
Schistosoma mansoni	nuclear hormone receptor	0.0358	0.02	0.0362
Schistosoma mansoni	tar DNA-binding protein	0.0073	0.0019	0.0035
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0358	0.02	0.02
Trichomonas vaginalis	voltage and ligand gated potassium channel, putative	0.0075	0.0021	0.0166
Entamoeba histolytica	phosphatidylinositol 3-kinase, putative	0.0515	0.03	0.3395
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.0758	0.0455	0.0823
Entamoeba histolytica	hypothetical protein	0.0265	0.0141	0.1305
Loa Loa (eye worm)	hypothetical protein	0.04	0.0227	0.2734
Trichomonas vaginalis	phosphatidylinositol 4-kinase, putative	0.0376	0.0212	0.2576
Brugia malayi	Nuclear hormone receptor-like 1	0.0758	0.0455	0.5477
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0358	0.02	0.0362
Leishmania major	hypothetical protein, unknown function	0.0265	0.0141	0.0389
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.04	0.0227	0.0412
Echinococcus multilocularis		0.0265	0.0141	0.0141
Trypanosoma cruzi	phosphatidylinositol 3-kinase 2, putative	0.1117	0.0682	0.1968
Trypanosoma cruzi	phosphatidylinositol kinase related protein, putative	0.0297	0.0162	0.0466
Loa Loa (eye worm)	hypothetical protein	0.0069	0.0017	0.0207
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0758	0.0455	0.0455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1304	0.0802	1
Schistosoma mansoni	phosphatidylinositol 4-kinase	0.0265	0.0141	0.0256
Echinococcus multilocularis	serine:threonine protein kinase PLK1	0.0109	0.0042	0.0042
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.0758	0.0455	0.5477
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.0758	0.0455	0.0455
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1304	0.0802	1
Brugia malayi	Nuclear hormone receptor-like 1	0.04	0.0227	0.2741
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.0265	0.0141	0.1687
Trichomonas vaginalis	PIKK family atypical protein kinase	0.126	0.0773	0.9642
Echinococcus multilocularis	thyroid hormone receptor alpha	0.0758	0.0455	0.0455
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.0758	0.0455	0.5477
Echinococcus granulosus	phosphatidylinositol 45 bisphosphate 3 kinase	0.1491	0.092	0.092
Mycobacterium ulcerans	cytochrome P450 185A4 Cyp185A4	0.0063	0.0013	0.0709
Entamoeba histolytica	hypothetical protein	0.0265	0.0141	0.1305
Echinococcus granulosus	PIK kinase FAT and Armadillo domain containing protein	0.0526	0.0307	0.0307
Plasmodium vivax	phosphatidylinositol 3-kinase, putative	0.0376	0.0212	1
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.0758	0.0455	1
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Loa Loa (eye worm)	cytochrome P450 family protein	0.0063	0.0013	0.016
Echinococcus granulosus	FKBP12 rapamycin complex associated protein	0.1304	0.0802	0.0802
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0745	0.0446	0.538
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0265	0.0141	0.0408
Brugia malayi	nuclear hormone receptor	0.0758	0.0455	0.5477
Echinococcus granulosus	potassium voltage gated channel subfamily H	0.008	0.0024	0.0024
Echinococcus multilocularis	Phosphatidylinositol 4 kinase type 2 beta	0.0265	0.0141	0.0141
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0358	0.02	0.02
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0358	0.02	0.02
Entamoeba histolytica	hypothetical protein	0.0978	0.0594	0.7268
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.0758	0.0455	0.5477
Schistosoma mansoni	nuclear receptor	0.0358	0.02	0.0362
Echinococcus granulosus	phosphatidylinositol 4 kinase beta	0.0265	0.0141	0.0141
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Brugia malayi	RNA binding protein	0.0073	0.0019	0.0235
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1284	0.0789	0.9841
Loa Loa (eye worm)	cytochrome P450 family protein	0.0063	0.0013	0.016
Trichomonas vaginalis	PIKK family atypical protein kinase	0.124	0.0761	0.9482
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Echinococcus granulosus	nuclear receptor nhr 48	0.0358	0.02	0.02
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Trichomonas vaginalis	phosphatidylinositol 3-kinase class, putative	0.0376	0.0212	0.2576
Leishmania major	phosphatidylinositol 4-kinase, putative	0.0265	0.0141	0.0389
Schistosoma mansoni	thyroid hormone receptor	0.0758	0.0455	0.0823
Brugia malayi	nuclear receptor NHR-88	0.0358	0.02	0.2412
Trichomonas vaginalis	phopsphatidylinositol 3-kinase, drosophila, putative	0.1117	0.0682	0.8498
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.0758	0.0455	0.0455
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.0758	0.0455	0.5477
Brugia malayi	hypothetical protein	0.04	0.0227	0.2741
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0358	0.02	0.02
Toxoplasma gondii	phosphatidylinositol 3- and 4-kinase	0.0376	0.0212	0.2697
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit alpha, beta, delta, putative	0.0904	0.0547	0.6796
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Trypanosoma cruzi	hypothetical protein, conserved	0.5502	0.3468	1
Trypanosoma cruzi	phosphatidylinositol 4-kinase, putative	0.0265	0.0141	0.0408
Trichomonas vaginalis	conserved hypothetical protein	0.0791	0.0476	0.5896
Echinococcus multilocularis	PIK kinase, FAT and Armadillo domain containing protein	0.0526	0.0307	0.0307
Trichomonas vaginalis	PIKK family atypical protein kinase	0.126	0.0773	0.9642
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0358	0.02	0.02
Brugia malayi	Phosphatidylinositol 3- and 4-kinase family protein	0.0713	0.0426	0.5137
Brugia malayi	RNA recognition motif domain containing protein	0.0073	0.0019	0.0235
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0358	0.02	0.02
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Echinococcus granulosus	FTZ F1 alpha	0.0758	0.0455	0.0455
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.0758	0.0455	0.5477
Loa Loa (eye worm)	hypothetical protein	0.04	0.0227	0.2734
Trypanosoma brucei	phosphatidylinositol kinase related protein, putative	0.0745	0.0446	0.5569
Plasmodium falciparum	phosphatidylinositol 3-kinase	0.0376	0.0212	1
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0358	0.02	0.2412
Trichomonas vaginalis	phosphatidylinositol 3-kinase catalytic subunit gamma, putative	0.1117	0.0682	0.8498
Brugia malayi	nuclear hormone receptor	0.0358	0.02	0.2412
Trypanosoma cruzi	phosphatidylinositol 3-kinase, putative	0.025	0.0132	0.038
Loa Loa (eye worm)	phosphatidylinositol 3	0.0265	0.0141	0.1699
Echinococcus multilocularis	potassium voltage gated channel subfamily H	0.008	0.0024	0.0024
Trichomonas vaginalis	PIKK family atypical protein kinase	0.124	0.0761	0.9482
Trypanosoma cruzi	cytochrome P450, putative	0.0063	0.0013	0.0038
Trypanosoma cruzi	phosphatidylinositol 4-kinase alpha, putative	0.0376	0.0212	0.0611
Loa Loa (eye worm)	phosphatidylinositol 3	0.1263	0.0775	0.9321
Loa Loa (eye worm)	hypothetical protein	0.0358	0.02	0.2407
Trichomonas vaginalis	PIKK family atypical protein kinase	0.0836	0.0504	0.6254
Schistosoma mansoni	phosphatidylinositol-45-bisphosphate 3-kinase catalytic subunit alpha PI3K	0.0376	0.0212	0.0384
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Echinococcus multilocularis	phosphatidylinositol 4 phosphate 3 kinase C2	0.0728	0.0435	0.0435
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.0758	0.0455	0.5464
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.0758	0.0455	0.0455
Loa Loa (eye worm)	hypothetical protein	0.0758	0.0455	0.5464
Leishmania major	phosphatidylinositol 3-kinase, putative	0.0376	0.0212	0.0583
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1279	0.0786	0.98
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.04	0.0227	0.0227
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0758	0.0455	0.0823
Loa Loa (eye worm)	steroid hormone receptor	0.0758	0.0455	0.5464
Loa Loa (eye worm)	voltage and ligand gated potassium channel	0.008	0.0024	0.0287
Trypanosoma cruzi	polo-like protein kinase, putative	0.0109	0.0042	0.0122
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1284	0.0789	0.9841
Brugia malayi	Steroid receptor seven-up type 2	0.0758	0.0455	0.5477
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.0758	0.0455	0.0823
Trichomonas vaginalis	CAMK family protein kinase	0.0109	0.0042	0.044
Schistosoma mansoni	phosphatidylinositol 3-kinase class	0.0265	0.0141	0.0256
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0358	0.02	0.02
Loa Loa (eye worm)	hypothetical protein	0.0713	0.0426	0.5124
Brugia malayi	nuclear receptor RXR	0.0358	0.02	0.2412
Leishmania major	phosphatidylinositol 4-kinase alpha, putative	0.0376	0.0212	0.0583
Loa Loa (eye worm)	hypothetical protein	0.048	0.0278	0.3344
Brugia malayi	photoreceptor-specific nuclear receptor	0.0758	0.0455	0.5477
Schistosoma mansoni	nuclear hormone receptor	0.0358	0.02	0.0362
Schistosoma mansoni	retinoic acid receptor RXR	0.0758	0.0455	0.0823
Toxoplasma gondii	target of rapamycin (TOR), putative	0.1279	0.0786	1
Schistosoma mansoni	thyroid hormone receptor	0.0758	0.0455	0.0823
Giardia lamblia	Phosphoinositide-3-kinase, catalytic, alpha polypeptide	0.0765	0.0459	0.5488
Mycobacterium tuberculosis	Probable oxidoreductase	0.0338	0.0188	1
Entamoeba histolytica	phosphatidylinositol-4,5-bisphosphate 3-kinase, putative	0.0376	0.0212	0.2234
Trypanosoma brucei	phosphatidylinositol 4-kinase, putative	0.1304	0.0802	1
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.04	0.0227	0.0227
Trichomonas vaginalis	PIKK family atypical protein kinase	0.1304	0.0802	1
Trichomonas vaginalis	phosphatidylinositol kinase, putative	0.0265	0.0141	0.1687

Activities

Activity type	Activity value	Assay description	Source	Reference
IC50 (binding)	= 0.5 nM	Inhibition of human full length 11beta-HSD1 assessed as inhibition of conversion of [3H]cortisone to [3H]cortisol by scintillation proximity assay	ChEMBL.	21093258
IC50 (binding)	= 12 nM	Inhibition of human recombinant full length 11beta-HSD1 expressed in human adipocytes assessed as inhibition of conversion of [3H]cortisone to [3H]cortisol by scintillation proximity assay in presence of 3% human serum albumin	ChEMBL.	21093258
IC50 (binding)	= 15 nM	Inhibition of human recombinant full length 11beta-HSD1 expressed in HEK293 cells assessed as inhibition of conversion of [3H]cortisone to [3H]cortisol by scintillation proximity assay	ChEMBL.	21093258
IC50 (binding)	= 34 nM	Inhibition of human recombinant full length 11beta-HSD1 expressed in HEK293 cells assessed as inhibition of conversion of [3H]cortisone to [3H]cortisol by scintillation proximity assay in presence of 3% human serum albumin	ChEMBL.	21093258

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

ChEMBL: CHEMBL1642601

Bibliographic References

1 literature reference was collected for this gene.

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Detailed information for compound 1464780