TDR Targets

Basic information

Technical information

Name: Unnamed compound
MW: 462.476 | Formula: C20H22N4O7S
H donors: 5 H acceptors: 7 LogP: 0.04 Rotable bonds: 13
Rule of 5 violations (Lipinski): 1
SMILES: O=C(CNC(=O)c1ccc(cc1)S(=O)(=O)N)NCC(=O)N[C@H](C(=O)O)Cc1ccccc1
InChi: 1S/C20H22N4O7S/c21-32(30,31)15-8-6-14(7-9-15)19(27)23-11-17(25)22-12-18(26)24-16(20(28)29)10-13-4-2-1-3-5-13/h1-9,16H,10-12H2,(H,22,25)(H,23,27)(H,24,26)(H,28,29)(H2,21,30,31)/t16-/m0/s1
InChiKey: FHOZBYUNMRNVLS-INIZCTEOSA-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	carbonic anhydrase II	Starlite/ChEMBL	No references

Predicted pathogen targets for this compound

By orthology

Species	Potential target	Known druggable target/s	Ortholog Group
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	Get druggable targets OG5_127628	All targets in OG5_127628
Leishmania mexicana	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Echinococcus granulosus	carbonic anhydrase II	Get druggable targets OG5_127628	All targets in OG5_127628
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	Get druggable targets OG5_127628	All targets in OG5_127628
Trypanosoma congolense	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	Get druggable targets OG5_127628	All targets in OG5_127628
Trypanosoma brucei	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Trypanosoma brucei gambiense	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Leishmania major	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Echinococcus multilocularis	carbonic anhydrase II	Get druggable targets OG5_127628	All targets in OG5_127628
Loa Loa (eye worm)	carbonic anhydrase 3	Get druggable targets OG5_127628	All targets in OG5_127628
Leishmania donovani	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Brugia malayi	Putative carbonic anhydrase 5 precursor	Get druggable targets OG5_127628	All targets in OG5_127628
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	Get druggable targets OG5_127628	All targets in OG5_127628
Leishmania infantum	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	Get druggable targets OG5_127628	All targets in OG5_127628
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	Get druggable targets OG5_127628	All targets in OG5_127628
Schistosoma japonicum	ko:K01672 carbonic anhydrase [EC4.2.1.1], putative	Get druggable targets OG5_127628	All targets in OG5_127628
Trypanosoma congolense	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628
Leishmania braziliensis	carbonic anhydrase-like protein	Get druggable targets OG5_127628	All targets in OG5_127628

By sequence similarity to non orthologous known druggable targets

Species	Potential target	Known druggable target	Length	Alignment span	Identity
Brugia malayi	Carbonic anhydrase like protein 2 precursor	carbonic anhydrase II	260 aa	259 aa	32.0 %

Ranking Plot

Putative Targets List

Species	Potential target	Raw	Global	Species
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.5503	0.6335	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.2068	0.2331	0.4923
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus granulosus	Nuclear hormone receptor family member nhr 41	0.04	0.0386	0.0391
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Toxoplasma gondii	hypothetical protein	0.4128	0.4733	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.04	0.0386	0.0391
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.2068	0.2331	0.2372
Schistosoma mansoni	thyroid hormone receptor	0.04	0.0386	0.0391
Echinococcus multilocularis	calcium:calmodulin dependent 3',5' cyclic	0.8492	0.9819	1
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.1375	0.1523	0.8799
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-1	0.04	0.0386	0.0384
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0188	0.014	0.0141
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Brugia malayi	conserved hypotetical protein	0.0188	0.014	0.0138
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0188	0.014	0.0141
Brugia malayi	nuclear receptor subfamily 1, group D, member 1, putative	0.0188	0.014	0.0138
Mycobacterium tuberculosis	Two component sensor histidine kinase DosT	0.1553	0.173	1
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.653
Loa Loa (eye worm)	hypothetical protein	0.1553	0.173	0.1729
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Brugia malayi	Nuclear hormone receptor-like 1	0.0211	0.0166	0.0164
Onchocerca volvulus		0.0188	0.014	0.0261
Schistosoma mansoni	hypothetical protein	0.0127	0.0068	0.0067
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.2068	0.2331	0.4923
Trypanosoma brucei	carbonic anhydrase-like protein	0.0147	0.0092	0.0133
Brugia malayi	Nuclear hormone receptor family member nhr-40	0.04	0.0386	0.0384
Echinococcus granulosus	high affinity cAMP specific 3'5' cyclic	0.1375	0.1523	0.1549
Echinococcus multilocularis	hepatocyte nuclear factor 4 alpha	0.04	0.0386	0.0391
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.5503	0.6335	1
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Plasmodium vivax	phosphodiesterase gamma, putative	0.1375	0.1523	0.653
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Plasmodium falciparum	cGMP-specific phosphodiesterase	0.1375	0.1523	0.8799
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0147	0.0092	0.0092
Trypanosoma brucei	cAMP-specific phosphodiesterase	0.5503	0.6335	1
Brugia malayi	tailless protein	0.0188	0.014	0.0138
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.2928	0.3333	0.526
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.2068	0.2331	0.3679
Brugia malayi	Nuclear hormone receptor-like 1	0.0211	0.0166	0.0164
Schistosoma mansoni	microtubule-associated protein tau	0.1617	0.1805	0.1837
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Onchocerca volvulus		0.0188	0.014	0.0261
Onchocerca volvulus	Bile acid receptor homolog	0.04	0.0386	0.0728
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-49	0.04	0.0386	0.0384
Loa Loa (eye worm)	hypothetical protein	0.0181	0.0131	0.0129
Schistosoma mansoni	calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase	0.8492	0.9819	1
Trypanosoma cruzi	cyclic nucleotide phosphodiesterase	0.1375	0.1523	0.2404
Brugia malayi	GH02984p	0.0408	0.0396	0.0394
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.2774	0.3154	0.321
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.04	0.0386	0.0391
Trypanosoma cruzi	cysteine peptidase, putative	0.0075	0.0008	0.0012
Echinococcus multilocularis	high affinity choline transporter 1	0.0408	0.0396	0.0402
Mycobacterium ulcerans	putative regulatory protein	0.1553	0.173	0.5
Loa Loa (eye worm)	hypothetical protein	0.0211	0.0166	0.0164
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Onchocerca volvulus	Protein ultraspiracle homolog	0.04	0.0386	0.0728
Brugia malayi	steroid hormone receptor	0.04	0.0386	0.0384
Brugia malayi	hypothetical protein	0.0211	0.0166	0.0164
Echinococcus granulosus	nuclear receptor nhr 48	0.0188	0.014	0.0141
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.5503	0.6335	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-41	0.04	0.0386	0.0384
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Schistosoma mansoni	high-affinity choline transporter	0.0408	0.0396	0.0402
Echinococcus granulosus	Nuclear hormone receptor HR96	0.0188	0.014	0.0141
Mycobacterium tuberculosis	Probable membrane NADH dehydrogenase NdhA	0.0253	0.0215	0.0984
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.2774	0.3154	0.321
Schistosoma mansoni	nuclear receptor	0.0188	0.014	0.0141
Echinococcus granulosus	cAMP and cAMP inhibited cGMP 3'5' cyclic	0.2928	0.3333	0.3393
Echinococcus multilocularis	high affinity cAMP specific 3',5' cyclic	0.1375	0.1523	0.1549
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Loa Loa (eye worm)	nuclear receptor NHR-67	0.0188	0.014	0.0138
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2401
Echinococcus granulosus	high affinity cgmp specific 3' 5' cyclic	0.1375	0.1523	0.1549
Brugia malayi	nuclear receptor NHR-88	0.0188	0.014	0.0138
Loa Loa (eye worm)	eukaryotic-type carbonic anhydrase	0.0147	0.0092	0.009
Echinococcus granulosus	COUP TF:Svp nuclear hormone receptor	0.04	0.0386	0.0391
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.04	0.0386	0.0384
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Mycobacterium tuberculosis	Dihydrolipoamide dehydrogenase LpdC (lipoamide reductase (NADH)) (lipoyl dehydrogenase) (dihydrolipoyl dehydrogenase) (diaphoras	0.0281	0.0248	0.118
Plasmodium falciparum	phosphodiesterase delta, putative	0.1375	0.1523	0.8799
Echinococcus multilocularis	high affinity cgmp specific 3' 5' cyclic	0.1375	0.1523	0.1549
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0188	0.014	0.0261
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Loa Loa (eye worm)	steroid hormone receptor	0.04	0.0386	0.0384
Schistosoma mansoni	photoreceptor-specific nuclear receptor related	0.04	0.0386	0.0391
Brugia malayi	nuclear hormone receptor family member nhr-6	0.0188	0.014	0.0138
Echinococcus multilocularis	dual 3',5' cyclic AMP and GMP phosphodiesterase	0.5503	0.6335	0.6451
Schistosoma mansoni	caspase-7 (C14 family)	0.0181	0.0131	0.0132
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.04	0.0386	0.0391
Mycobacterium tuberculosis	Probable dehydrogenase	0.0253	0.0215	0.0984
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.8799
Loa Loa (eye worm)	hypothetical protein	0.8647	1	1
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Loa Loa (eye worm)	hypothetical protein	0.7272	0.8397	0.8397
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.395	0.4525	0.7142
Brugia malayi	nuclear receptor RXR	0.0211	0.0166	0.0164
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Echinococcus multilocularis	retinoic acid receptor rxr beta a retinoic acid receptor rxr alpha a retinoic acid receptor rxr alpha	0.0188	0.014	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.4128	0.4733	0.747
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Brugia malayi	Nuclear hormone receptor family member nhr-3	0.04	0.0386	0.0384
Leishmania major	carbonic anhydrase-like protein	0.0147	0.0092	0.0133
Trypanosoma cruzi	cAMP-specific phosphodiesterase, putative	0.1375	0.1523	0.2404
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.1399	0.1551	0.1578
Onchocerca volvulus		0.04	0.0386	0.0728
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus granulosus	hepatocyte nuclear factor 4 alpha	0.04	0.0386	0.0391
Leishmania major	hypothetical protein, conserved	0.1375	0.1523	0.2395
Trichomonas vaginalis	conserved hypothetical protein	0.1553	0.173	0.2729
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Schistosoma mansoni	retinoic acid receptor RXR	0.04	0.0386	0.0391
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.5503	0.6335	1
Plasmodium falciparum	glutathione reductase	0.0111	0.0049	0.0274
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Brugia malayi	Eukaryotic-type carbonic anhydrase family protein	0.0147	0.0092	0.009
Schistosoma mansoni	Tr4/Tr2 (homologue)	0.04	0.0386	0.0391
Echinococcus granulosus	nuclear receptor subfamily 1 group D	0.0211	0.0166	0.0167
Echinococcus granulosus	carbonic anhydrase II	0.0147	0.0092	0.0092
Loa Loa (eye worm)	nuclear receptor nhr-7B	0.4386	0.5033	0.5032
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Brugia malayi	Thioredoxin reductase	0.0111	0.0049	0.0047
Trichomonas vaginalis	conserved hypothetical protein	0.4128	0.4733	0.747
Brugia malayi	ecdysteroid receptor	0.04	0.0386	0.0384
Loa Loa (eye worm)	hypothetical protein	0.1375	0.1523	0.1521
Loa Loa (eye worm)	carbonic anhydrase 3	0.0147	0.0092	0.009
Mycobacterium tuberculosis	NAD(P)H quinone reductase LpdA	0.0281	0.0248	0.118
Echinococcus granulosus	microtubule associated protein 2	0.1617	0.1805	0.1837
Trypanosoma cruzi	cAMP phosphodiesterase A, putative	0.2068	0.2331	0.3679
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.04	0.0386	0.0391
Schistosoma mansoni	nuclear receptor 2DBD-gamma	0.04	0.0386	0.0391
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative	0.2928	0.3333	0.3332
Trichomonas vaginalis	cAMP/cGMP cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Giardia lamblia	CAMP-specific 3,5-cyclic phosphodiesterase 4B	0.2774	0.3154	1
Toxoplasma gondii	hypothetical protein	0.1553	0.173	0.3654
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.0211	0.0166	0.0167
Loa Loa (eye worm)	nuclear hormone receptor-like 1	0.0211	0.0166	0.0164
Echinococcus multilocularis	microtubule associated protein 2	0.1617	0.1805	0.1837
Brugia malayi	Nuclear hormone receptor family member nhr-41	0.04	0.0386	0.0384
Schistosoma mansoni	nuclear hormone receptor	0.0188	0.014	0.0141
Toxoplasma gondii	GAF domain-containing protein	0.1553	0.173	0.3654
Brugia malayi	Steroid receptor seven-up type 2	0.04	0.0386	0.0384
Loa Loa (eye worm)	PDE1B protein	0.8492	0.9819	0.9819
Echinococcus granulosus	nuclear receptor 2DBD gamma	0.0188	0.014	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.4128	0.4733	0.747
Echinococcus multilocularis	Nuclear hormone receptor HR96	0.0188	0.014	0.0141
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2401
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus multilocularis	caspase 2	0.0181	0.0131	0.0132
Trypanosoma brucei	trypanothione reductase	0.0111	0.0049	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0211	0.0166	0.0164
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.2068	0.2331	0.2372
Trypanosoma brucei	hypothetical protein, conserved	0.1375	0.1523	0.2395
Echinococcus multilocularis	FTZ F1 alpha	0.04	0.0386	0.0391
Echinococcus granulosus	high affinity choline transporter 1	0.0408	0.0396	0.0402
Echinococcus granulosus	nuclear receptor subfamily 4 group A	0.0188	0.014	0.0141
Echinococcus multilocularis	cAMP and cAMP inhibited cGMP 3',5' cyclic	0.2928	0.3333	0.3393
Mycobacterium tuberculosis	Probable NADH dehydrogenase Ndh	0.0253	0.0215	0.0984
Brugia malayi	nuclear hormone receptor family member odr-7	0.0188	0.014	0.0138
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Schistosoma mansoni	FTZ-F1 nuclear receptor-like protein	0.04	0.0386	0.0391
Mycobacterium ulcerans	putative regulatory protein	0.1553	0.173	0.5
Brugia malayi	orphan nuclear receptor NR2E1	0.0188	0.014	0.0138
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2395
Mycobacterium tuberculosis	Probable oxidoreductase	0.0281	0.0248	0.118
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-31	0.04	0.0386	0.0384
Mycobacterium tuberculosis	Probable reductase	0.0253	0.0215	0.0984
Brugia malayi	Cell death protein 3 precursor	0.0181	0.0131	0.0129
Plasmodium vivax	hypothetical protein, conserved	0.1553	0.173	0.7422
Trichomonas vaginalis	cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Plasmodium falciparum	thioredoxin reductase	0.0111	0.0049	0.0274
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2401
Echinococcus granulosus	ecdysone induced protein 78C	0.04	0.0386	0.0391
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Echinococcus multilocularis	ecdysone induced protein 78C	0.04	0.0386	0.0391
Trichomonas vaginalis	cGMP-inhibited 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Schistosoma mansoni	nuclear hormone receptor	0.04	0.0386	0.0391
Trichomonas vaginalis	cAMP-specific phosphodiesterase, putative	0.395	0.4525	0.7142
Mycobacterium tuberculosis	Possible penicillin-binding protein	0.027	0.0235	0.1106
Mycobacterium leprae	conserved hypothetical protein	0.1553	0.173	1
Trypanosoma cruzi	trypanothione reductase, putative	0.0111	0.0049	0.0078
Schistosoma mansoni	hepatocyte nuclear factor 4-alpha (hnf-4-alpha)	0.0188	0.014	0.0141
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Loa Loa (eye worm)	hypothetical protein	0.0127	0.0068	0.0066
Loa Loa (eye worm)	hypothetical protein	0.0211	0.0166	0.0164
Schistosoma mansoni	ecdysone-induced protein 78c (dr-78)	0.0211	0.0166	0.0167
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0147	0.0092	0.0145
Mycobacterium tuberculosis	Probable nitrite reductase [NAD(P)H] large subunit [FAD flavoprotein] NirB	0.0253	0.0215	0.0984
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-40	0.04	0.0386	0.0384
Echinococcus granulosus	thioredoxin glutathione reductase	0.0111	0.0049	0.0048
Schistosoma mansoni	steroid hormone receptor ad4bp	0.04	0.0386	0.0391
Schistosoma mansoni	zinc finger protein	0.0188	0.014	0.0141
Echinococcus granulosus	apoptotic protease activating factor 1	0.0127	0.0068	0.0067
Schistosoma mansoni	thyroid hormone receptor	0.04	0.0386	0.0391
Trichomonas vaginalis	rod cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus granulosus	calcium:calmodulin dependent 3'5' cyclic	0.8492	0.9819	1
Schistosoma mansoni	camp/cgmp cyclic nucleotide phosphodiesterase	0.5503	0.6335	0.6451
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Echinococcus multilocularis	thyroid hormone receptor alpha	0.04	0.0386	0.0391
Leishmania major	hypothetical protein, conserved	0.1375	0.1523	0.2395
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Brugia malayi	hypothetical protein	0.0211	0.0166	0.0164
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.2928	0.3333	0.526
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Schistosoma mansoni	memapsin-2 (A01 family)	0.0908	0.0979	0.0995
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Brugia malayi	Nuclear hormone receptor E75	0.0188	0.014	0.0138
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.2774	0.3154	0.321
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Echinococcus granulosus	FTZ F1 nuclear receptor protein	0.04	0.0386	0.0391
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Schistosoma mansoni	camp-specific cyclic nucleotide phosphodiesterase	0.1375	0.1523	0.1549
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.3423	0.3911	0.391
Leishmania major	trypanothione reductase	0.0111	0.0049	0.0066
Loa Loa (eye worm)	DR-78	0.0188	0.014	0.0138
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.1399	0.1551	0.155
Brugia malayi	Nuclear hormone receptor family member nhr-14	0.04	0.0386	0.0384
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.2774	0.3154	0.6662
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Plasmodium falciparum	GAF domain-related protein, putative	0.1553	0.173	1
Trypanosoma cruzi	carbonic anhydrase-like protein, putative	0.0147	0.0092	0.0145
Schistosoma mansoni	carbonic anhydrase II (carbonate dehydratase II)	0.0147	0.0092	0.0092
Brugia malayi	glutathione reductase	0.0111	0.0049	0.0047
Brugia malayi	hypothetical protein	0.0188	0.014	0.0138
Trichomonas vaginalis	conserved hypothetical protein	0.1375	0.1523	0.2401
Leishmania major	cAMP-specific phosphodiesterase, putative	0.1375	0.1523	0.2395
Loa Loa (eye worm)	nuclear Hormone Receptor family member	0.04	0.0386	0.0384
Loa Loa (eye worm)	glutathione reductase	0.0111	0.0049	0.0047
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.04	0.0386	0.0384
Brugia malayi	nuclear receptor RXR	0.0188	0.014	0.0138
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.2928	0.3333	0.526
Brugia malayi	photoreceptor-specific nuclear receptor	0.04	0.0386	0.0384
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Echinococcus granulosus	FTZ F1 alpha	0.04	0.0386	0.0391
Brugia malayi	3'5'-cyclic nucleotide phosphodiesterase family protein	0.1375	0.1523	0.1521
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Trichomonas vaginalis	cAMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus multilocularis	Nuclear hormone receptor family member nhr 41	0.04	0.0386	0.0391
Brugia malayi	Nuclear hormone receptor family member nhr-1	0.04	0.0386	0.0384
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Schistosoma mansoni	nuclear receptor nhr-48	0.0188	0.014	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0211	0.0166	0.0164
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Echinococcus multilocularis	carbonic anhydrase II	0.0147	0.0092	0.0092
Schistosoma mansoni	camp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Loa Loa (eye worm)	hypothetical protein	0.4197	0.4813	0.4812
Brugia malayi	Nuclear hormone receptor family member nhr-31	0.04	0.0386	0.0384
Trichomonas vaginalis	cGMP-dependent 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Brugia malayi	Nuclear hormone receptor family member nhr-19	0.04	0.0386	0.0384
Echinococcus multilocularis	thioredoxin glutathione reductase	0.0111	0.0049	0.0048
Onchocerca volvulus		0.0127	0.0068	0.0125
Schistosoma mansoni	nuclear hormone receptor superfamily protein-related	0.0188	0.014	0.0141
Trichomonas vaginalis	conserved hypothetical protein	0.1375	0.1523	0.2401
Trypanosoma cruzi	cysteine peptidase, putative	0.0075	0.0008	0.0012
Trypanosoma cruzi	cysteine peptidase, putative	0.0075	0.0008	0.0012
Brugia malayi	Nuclear hormone receptor-like 1	0.04	0.0386	0.0384
Toxoplasma gondii	hypothetical protein	0.1553	0.173	0.3654
Schistosoma mansoni	cgmp-dependent 35-cyclic phosphodiesterase	0.3423	0.3911	0.3981
Schistosoma mansoni	retinoid-x-receptor (RXR)	0.04	0.0386	0.0391
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase T04D3.3, putative	0.8492	0.9819	0.9819
Loa Loa (eye worm)	nuclear hormone receptor family member nhr-14	0.04	0.0386	0.0384
Trypanosoma brucei	cAMP-specific phosphodiesterase, putative	0.1375	0.1523	0.2395
Schistosoma mansoni	nuclear hormone receptor nor-1/nor-2	0.04	0.0386	0.0391
Brugia malayi	nuclear hormone receptor	0.4386	0.5033	0.5032
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.2774	0.3154	0.321
Echinococcus multilocularis	apoptotic protease activating factor 1	0.0127	0.0068	0.0067
Leishmania major	cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100	0.2068	0.2331	0.3672
Brugia malayi	hypothetical protein	0.0188	0.014	0.0138
Trypanosoma cruzi	cruzipain precursor, putative	0.0075	0.0008	0.0012
Trichomonas vaginalis	cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Schistosoma mansoni	coup transcription factor	0.04	0.0386	0.0391
Trichomonas vaginalis	conserved hypothetical protein	0.5503	0.6335	1
Plasmodium vivax	glutathione reductase, putative	0.0111	0.0049	0.0204
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.04	0.0386	0.0384
Brugia malayi	Putative carbonic anhydrase 5 precursor	0.0147	0.0092	0.009
Schistosoma mansoni	nuclear hormone receptor	0.0188	0.014	0.0141
Schistosoma mansoni	RAR-like nuclear receptor	0.04	0.0386	0.0391
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Loa Loa (eye worm)	hypothetical protein	0.0211	0.0166	0.0164
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Brugia malayi	nuclear receptor NHR-88	0.04	0.0386	0.0384
Onchocerca volvulus	Cell death protein 3 homolog	0.0181	0.0131	0.0245
Trichomonas vaginalis	calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus multilocularis	FTZ F1 nuclear receptor protein	0.04	0.0386	0.0391
Loa Loa (eye worm)	calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase	0.1375	0.1523	0.1521
Plasmodium vivax	cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.653
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Plasmodium falciparum	3',5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.8799
Echinococcus multilocularis	nuclear receptor 2DBD gamma	0.0188	0.014	0.0141
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Loa Loa (eye worm)	nuclear hormone receptor	0.0188	0.014	0.0138
Loa Loa (eye worm)	hypothetical protein	0.2774	0.3154	0.3152
Brugia malayi	Nuclear hormone receptor E75	0.0188	0.014	0.0138
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.5503	0.6335	1
Echinococcus granulosus	retinoic acid receptor rxr beta a	0.04	0.0386	0.0391
Mycobacterium leprae	DIHYDROLIPOAMIDE DEHYDROGENASE LPD (LIPOAMIDE REDUCTASE (NADH)) (LIPOYL DEHYDROGENASE) (DIHYDROLIPOYL DEHYDROGENASE) (DIAPHORASE	0.0281	0.0248	0.0217
Brugia malayi	nuclear hormone receptor	0.04	0.0386	0.0384
Echinococcus granulosus	cAMP specific 3'5' cyclic phosphodiesterase	0.2774	0.3154	0.321
Trichomonas vaginalis	cone cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.5503	0.6335	1
Plasmodium vivax	thioredoxin reductase, putative	0.0111	0.0049	0.0204
Toxoplasma gondii	thioredoxin reductase	0.0111	0.0049	0.01
Echinococcus multilocularis	cAMP specific 3',5' cyclic phosphodiesterase	0.1399	0.1551	0.1578
Plasmodium vivax	3',5'-cyclic nucleotide phosphodiesterase, putative	0.2068	0.2331	1
Trichomonas vaginalis	cyclic nucleotide phosphodiesterase, putative	0.5503	0.6335	1
Onchocerca volvulus	Steroid hormone receptor family member cnr14 homolog	0.4597	0.5279	1
Brugia malayi	ecdysone receptor	0.0188	0.014	0.0138
Echinococcus multilocularis	nuclear receptor subfamily 1 group D	0.0211	0.0166	0.0167
Loa Loa (eye worm)	hypothetical protein	0.0188	0.014	0.0138
Brugia malayi	Nuclear hormone receptor family member nhr-25	0.04	0.0386	0.0384
Toxoplasma gondii	3'5'-cyclic nucleotide phosphodiesterase domain-containing protein	0.1375	0.1523	0.3215
Brugia malayi	Probable 3',5'-cyclic phosphodiesterase R153.1, putative	0.1375	0.1523	0.1521
Echinococcus granulosus	caspase 2	0.0181	0.0131	0.0132
Mycobacterium ulcerans	two component sensor histidine kinase DevS	0.1553	0.173	0.5
Brugia malayi	hypothetical protein	0.0127	0.0068	0.0066
Echinococcus granulosus	dual 3'5' cyclic AMP and GMP phosphodiesterase	0.5503	0.6335	0.6451
Trypanosoma brucei	3', 5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2395
Loa Loa (eye worm)	hypothetical protein	0.04	0.0386	0.0384
Echinococcus multilocularis	nuclear receptor subfamily 4 group A	0.0188	0.014	0.0141
Onchocerca volvulus	Nuclear receptor subfamily 6 group A member 1 homolog	0.0188	0.014	0.0261
Schistosoma mansoni	nuclear receptor	0.0188	0.014	0.0141
Echinococcus multilocularis	COUP TF:Svp nuclear hormone receptor	0.04	0.0386	0.0391
Echinococcus granulosus	thyroid hormone receptor alpha	0.0188	0.014	0.0141
Loa Loa (eye worm)	cyclic AMP specific phosphodiesterase PDE4D5A	0.1399	0.1551	0.155
Brugia malayi	Nuclear hormone receptor family member nhr-49	0.04	0.0386	0.0384
Trypanosoma cruzi	hypothetical protein, conserved	0.1375	0.1523	0.2404
Brugia malayi	Ligand-binding domain of nuclear hormone receptor family protein	0.04	0.0386	0.0384
Trichomonas vaginalis	high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative	0.1375	0.1523	0.2401
Trichomonas vaginalis	calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative	0.1375	0.1523	0.2401
Mycobacterium tuberculosis	Two component sensor histidine kinase DevS	0.1553	0.173	1
Loa Loa (eye worm)	thioredoxin reductase	0.0111	0.0049	0.0047
Brugia malayi	nuclear receptor NHR-67	0.0188	0.014	0.0138
Mycobacterium tuberculosis	Putative ferredoxin reductase	0.0253	0.0215	0.0984
Schistosoma mansoni	high-affinity cgmp-specific 35-cyclic phosphodiesterase	0.1375	0.1523	0.1549
Echinococcus multilocularis	nuclear receptor nhr 48	0.0188	0.014	0.0141
Trypanosoma brucei	cAMP phosphodiesterase A, putative	0.2068	0.2331	0.3672
Plasmodium falciparum	phosphodiesterase gamma, putative	0.1375	0.1523	0.8799
Loa Loa (eye worm)	hypothetical protein	0.3423	0.3911	0.391
Loa Loa (eye worm)	hypothetical protein	0.0408	0.0396	0.0394
Trypanosoma cruzi	cAMP specific phosphodiesterase, putative	0.395	0.4525	0.7143

Activities

Activity type	Activity value	Assay description	Source	Reference
Kd (binding)	= 140 nM	Dissociation constant against human carbonic anhydrase II at 37 degree centigrade	ChEMBL.	No reference

Phenotypes

Whole-cell/tissue/organism interactions

We have no records of whole-cell/tissue assays done with this compound What does this mean?

Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.

Annotated phenotypes:

We have no manually annotated phenotypes for this drug. What does this mean? / Care to help?

In TDR Targets, information about phenotypes that are caused by drugs, or by genetic manipulation of cells (e.g. gene knockouts or knockdowns) is manually curated from the literature. These descriptions help to describe the potential of the target for drug development. If no information is available for this gene or if the information is incomplete, this may mean that i) the papers containing this information either appeared after the curation effort for this organism was carried out or they were inadvertently missed by curators; or that ii) the curation effort for this organism has not yet started.

In any case, if you have information about papers containing relevant validation data for this target, please log in using your TDR Targets username and password and send them to us using the corresponding form in this page (only visible to registered users) or contact us.

External resources for this compound

ChEMBL: CHEMBL2371065

Bibliographic References

No literature references available for this target.

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Detailed information for compound 1744500