Detailed information for compound 1805308

Basic information

Technical information
  • TDR Targets ID: 1805308
  • Name: (4S)-4-tert-butyl-2-[2-[(4S)-4-tert-butyl-4,5 -dihydro-1,3-oxazol-2-yl]propan-2-yl]-4,5-dih ydro-1,3-oxazole
  • MW: 294.432 | Formula: C17H30N2O2
  • H donors: 0 H acceptors: 0 LogP: 3.96 Rotable bonds: 4
    Rule of 5 violations (Lipinski): 1
  • SMILES: CC(C1=N[C@H](CO1)C(C)(C)C)(C1=N[C@H](CO1)C(C)(C)C)C
  • InChi: 1S/C17H30N2O2/c1-15(2,3)11-9-20-13(18-11)17(7,8)14-19-12(10-21-14)16(4,5)6/h11-12H,9-10H2,1-8H3/t11-,12-/m1/s1
  • InChiKey: DPMGLJUMNRDNMX-VXGBXAGGSA-N  


Substructure search Similarity search

Network

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Synonyms

  • (4S)-4-tert-butyl-2-[1-[(4S)-4-tert-butyl-4,5-dihydrooxazol-2-yl]-1-methyl-ethyl]-4,5-dihydrooxazole
  • (4S)-4-tert-butyl-2-[1-[(4S)-4-tert-butyl-4,5-dihydrooxazol-2-yl]-1-methylethyl]-4,5-dihydrooxazole
  • (S,S)-2,2′-Isopropylidene-bis(4-tert-butyl-2-oxazoline)
  • 2,2'-Isopropylidenebis[(4S)-4-tert-butyl-2-oxazoline]
  • 406147_ALDRICH
  • ZINC00056891

Targets

Known targets for this compound

No curated genes were found associated with this compound

Predicted pathogen targets for this compound

By orthology
No druggable targets predicted by orthology data
By sequence similarity to non orthologous known druggable targets
No druggable targets predicted by sequence similarity
Obtained from network model

Ranking Plot

Putative Targets List

Species Potential target Raw Global Species
Schistosoma mansoni hypothetical protein 0.0036 0.0038 0.0038
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0305 0.4239 0.4605
Schistosoma mansoni calcium/calmodulin-dependent 35-cyclic nucleotide phosphodiesterase 0.0673 1 1
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Toxoplasma gondii hypothetical protein 0.0138 0.1642 0.2592
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0228 0.3037 0.3221
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Trypanosoma brucei hypothetical protein, conserved 0.0089 0.0875 0.121
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0273 0.3743 0.5772
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Schistosoma mansoni neuroligin 3 (S09 family) 0.0049 0.0238 0.0238
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0089 0.0875 0.0875
Mycobacterium leprae conserved hypothetical protein 0.0138 0.1642 0.5
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0049 0.0238 0.0238
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Schistosoma mansoni transcription factor LCR-F1 0.0042 0.0131 0.0131
Schistosoma mansoni camp-specific cyclic nucleotide phosphodiesterase 0.0089 0.0875 0.0875
Mycobacterium tuberculosis Two component sensor histidine kinase DosT 0.0138 0.1642 0.7066
Leishmania major hypothetical protein, conserved 0.0089 0.0875 0.121
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0089 0.0875 0.0848
Trichomonas vaginalis conserved hypothetical protein 0.0354 0.5006 0.5487
Echinococcus granulosus family S9 non peptidase ue S09 family 0.0049 0.0238 0.0209
Brugia malayi Carboxylesterase family protein 0.0049 0.0238 0.0238
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Brugia malayi hypothetical protein 0.0049 0.0238 0.0238
Schistosoma mansoni BC026374 protein (S09 family) 0.0049 0.0238 0.0238
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0049 0.0238 0.0572
Mycobacterium tuberculosis POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) 0.0049 0.0238 0.0572
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.053 0.7758 0.7758
Toxoplasma gondii GAF domain-containing protein 0.0138 0.1642 0.2592
Echinococcus multilocularis neuroligin 0.0049 0.0238 0.0209
Echinococcus granulosus high affinity cgmp specific 3' 5' cyclic 0.0089 0.0875 0.0848
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0308 0.0279
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Brugia malayi glutaminase DH11.1 0.0605 0.8927 0.8927
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0483 0.7035 0.7822
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0228 0.3037 0.3221
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0305 0.4239 0.6562
Echinococcus multilocularis high affinity cAMP specific 3',5' cyclic 0.0089 0.0875 0.0848
Echinococcus multilocularis cAMP and cAMP inhibited cGMP 3',5' cyclic 0.0228 0.3037 0.3016
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Brugia malayi Carboxylesterase family protein 0.0049 0.0238 0.0238
Schistosoma mansoni cgmp-dependent 35-cyclic phosphodiesterase 0.0319 0.4471 0.4471
Echinococcus multilocularis GPCR, family 2 0.0036 0.0038 0.0009
Loa Loa (eye worm) hypothetical protein 0.0089 0.0875 0.0875
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Mycobacterium tuberculosis Carboxylesterase LipT 0.0049 0.0238 0.0572
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.013 0.151 0.1463
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Echinococcus multilocularis Basic leucine zipper (bZIP) transcription 0.0042 0.0131 0.0102
Toxoplasma gondii hypothetical protein 0.0138 0.1642 0.2592
Leishmania major hypothetical protein, conserved 0.0089 0.0875 0.121
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0673 1 1
Loa Loa (eye worm) calcium/calmodulin-stimulated cyclic nucleotide phosphodiesterase 0.0089 0.0875 0.0875
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Onchocerca volvulus 0.0175 0.2214 1
Onchocerca volvulus 0.0049 0.0238 0.1076
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0673 1 1
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.0733
Trichomonas vaginalis conserved hypothetical protein 0.0354 0.5006 0.5487
Loa Loa (eye worm) hypothetical protein 0.0089 0.0875 0.0875
Schistosoma mansoni hypothetical protein 0.0077 0.0686 0.0686
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Loa Loa (eye worm) hypothetical protein 0.0036 0.0038 0.0038
Brugia malayi 3'5'-cyclic nucleotide phosphodiesterase family protein 0.0319 0.4471 0.4471
Trypanosoma brucei cAMP-specific phosphodiesterase, putative 0.0089 0.0875 0.121
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Echinococcus multilocularis calcium:calmodulin dependent 3',5' cyclic 0.0273 0.3743 0.3725
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Giardia lamblia CAMP-specific 3,5-cyclic phosphodiesterase 4B 0.0089 0.0875 0.5
Loa Loa (eye worm) hypothetical protein 0.0175 0.2214 0.2214
Brugia malayi latrophilin 2 splice variant baaae 0.0077 0.0686 0.0686
Echinococcus multilocularis BC026374 protein (S09 family) 0.0049 0.0238 0.0209
Entamoeba histolytica hypothetical protein 0.0042 0.0131 0.5
Schistosoma mansoni hypothetical protein 0.0036 0.0038 0.0038
Echinococcus granulosus diuretic hormone 44 receptor GPRdih2 0.0036 0.0038 0.0009
Trichomonas vaginalis glutaminase, putative 0.0605 0.8927 1
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.121
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.0733
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0089 0.0875 0.0733
Entamoeba histolytica hypothetical protein 0.0042 0.0131 0.5
Onchocerca volvulus 0.0049 0.0238 0.1076
Entamoeba histolytica hypothetical protein 0.0042 0.0131 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0483 0.7035 0.7822
Plasmodium vivax 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0273 0.3743 1
Trichomonas vaginalis cAMP/cGMP cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Entamoeba histolytica hypothetical protein 0.0042 0.0131 0.5
Trichomonas vaginalis conserved hypothetical protein 0.0089 0.0875 0.0733
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0443 0.6401 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Brugia malayi hypothetical protein 0.0175 0.2214 0.2214
Echinococcus granulosus acetylcholinesterase 0.0287 0.3966 0.3948
Brugia malayi Corticotropin releasing factor receptor 2 precursor, putative 0.0113 0.1244 0.1244
Loa Loa (eye worm) acetylcholinesterase 1 0.0287 0.3966 0.3966
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0443 0.6401 1
Leishmania major cAMP-specific phosphodiesterase, putative 0.0089 0.0875 0.121
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0308 0.0279
Echinococcus multilocularis cAMP specific 3',5' cyclic phosphodiesterase 0.0089 0.0875 0.0848
Loa Loa (eye worm) glutaminase 0.0605 0.8927 0.8927
Echinococcus multilocularis cadherin EGF LAG seven pass G type receptor 0.0036 0.0038 0.0009
Schistosoma mansoni cpg binding protein 0.0035 0.003 0.003
Schistosoma mansoni gliotactin 0.0049 0.0238 0.0238
Loa Loa (eye worm) carboxylesterase 0.0049 0.0238 0.0238
Echinococcus granulosus para nitrobenzyl esterase 0.0049 0.0238 0.0209
Echinococcus multilocularis guanine nucleotide binding protein G(s) subunit 0.0053 0.0308 0.0279
Brugia malayi Carboxylesterase family protein 0.0287 0.3966 0.3966
Echinococcus granulosus dnaJ subfamily B 0.0474 0.6881 0.6872
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0287 0.3966 0.3966
Loa Loa (eye worm) hypothetical protein 0.0319 0.4471 0.4471
Echinococcus multilocularis dnaJ subfamily B 0.0474 0.6881 0.6872
Trypanosoma brucei 3', 5'-cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.121
Loa Loa (eye worm) hypothetical protein 0.0077 0.0686 0.0686
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Echinococcus granulosus Basic leucine zipper bZIP transcription 0.0042 0.0131 0.0102
Onchocerca volvulus 0.0049 0.0238 0.1076
Trypanosoma brucei cAMP phosphodiesterase A, putative 0.0273 0.3743 0.5772
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.013 0.151 0.1463
Trichomonas vaginalis cAMP and cAMP-inhibited cGMP 3,5-cyclic phosphodiesterase, putative 0.0089 0.0875 0.0733
Leishmania major cAMP phosphodiesterase A, putative;with=GeneDB:LinJ18_V3.1100 0.0273 0.3743 0.5772
Trichomonas vaginalis cGMP-dependent 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Brugia malayi Carboxylesterase family protein 0.0287 0.3966 0.3966
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Echinococcus granulosus BC026374 protein S09 family 0.0049 0.0238 0.0209
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0443 0.6401 0.7092
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0443 0.6401 1
Trypanosoma cruzi cAMP-specific phosphodiesterase, putative 0.0089 0.0875 0.121
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0228 0.3037 0.3221
Mycobacterium ulcerans glutaminase 0.0605 0.8927 1
Schistosoma mansoni camp/cgmp cyclic nucleotide phosphodiesterase 0.0443 0.6401 0.6401
Echinococcus granulosus GPCR family 2 0.0036 0.0038 0.0009
Brugia malayi Latrophilin receptor protein 2 0.0036 0.0038 0.0038
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Schistosoma mansoni cpg binding protein 0.0035 0.003 0.003
Echinococcus granulosus acetylcholinesterase 0.0287 0.3966 0.3948
Loa Loa (eye worm) hypothetical protein 0.0138 0.1642 0.1642
Schistosoma mansoni hypothetical protein 0.0474 0.6881 0.6881
Plasmodium vivax hypothetical protein, conserved 0.0138 0.1642 0.2672
Brugia malayi hypothetical protein 0.0042 0.0131 0.0131
Trichomonas vaginalis calcium/calmodulin-dependent 3',5'-cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.0733
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0273 0.3743 0.722
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Echinococcus multilocularis high affinity cgmp specific 3' 5' cyclic 0.0089 0.0875 0.0848
Trichomonas vaginalis conserved hypothetical protein 0.0354 0.5006 0.5487
Trypanosoma cruzi cAMP phosphodiesterase A, putative 0.0273 0.3743 0.5772
Schistosoma mansoni hypothetical protein 0.0036 0.0038 0.0038
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0308 0.0308
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Trichomonas vaginalis calcium/calmodulin-dependent 3,5-cyclic nucleotide phosphodiesterase, putative 0.0483 0.7035 0.7822
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0089 0.0875 0.0848
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0089 0.0875 0.0733
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Mycobacterium tuberculosis Two component sensor histidine kinase DevS 0.0179 0.2276 1
Loa Loa (eye worm) pigment dispersing factor receptor c 0.0113 0.1244 0.1244
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0089 0.0875 0.0733
Loa Loa (eye worm) hypothetical protein 0.0113 0.1244 0.1244
Loa Loa (eye worm) GTP-binding regulatory protein Gs alpha-S chain 0.0053 0.0308 0.0308
Echinococcus granulosus cAMP specific 3'5' cyclic phosphodiesterase 0.0089 0.0875 0.0848
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0443 0.6401 0.7092
Loa Loa (eye worm) latrophilin receptor protein 2 0.0036 0.0038 0.0038
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Mycobacterium ulcerans two component sensor histidine kinase DevS 0.0179 0.2276 0.2345
Onchocerca volvulus 0.0049 0.0238 0.1076
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0049 0.0238 0.0238
Schistosoma mansoni acetylcholinesterase 0.0049 0.0238 0.0238
Brugia malayi Carboxylesterase family protein 0.0049 0.0238 0.0238
Schistosoma mansoni glutaminase 0.0605 0.8927 0.8927
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Echinococcus granulosus neuroligin 0.0049 0.0238 0.0209
Loa Loa (eye worm) hypothetical protein 0.0049 0.0238 0.0238
Schistosoma mansoni hypothetical protein 0.0036 0.0038 0.0038
Brugia malayi calcium-independent alpha-latrotoxin receptor 2, putative 0.0036 0.0038 0.0038
Giardia lamblia Hypothetical protein 0.0089 0.0875 0.5
Brugia malayi Probable 3',5'-cyclic phosphodiesterase C32E12.2, putative 0.0228 0.3037 0.3037
Brugia malayi Calcitonin receptor-like protein seb-1 0.0113 0.1244 0.1244
Trypanosoma brucei cAMP-specific phosphodiesterase 0.0443 0.6401 1
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Trypanosoma cruzi cyclic nucleotide phosphodiesterase 0.0089 0.0875 0.121
Schistosoma mansoni family S9 non-peptidase homologue (S09 family) 0.0049 0.0238 0.0238
Onchocerca volvulus 0.0049 0.0238 0.1076
Trichomonas vaginalis cyclic nucleotide phosphodiesterase, putative 0.0483 0.7035 0.7822
Echinococcus multilocularis diuretic hormone 44 receptor GPRdih2 0.0036 0.0038 0.0009
Echinococcus multilocularis dual 3',5' cyclic AMP and GMP phosphodiesterase 0.0443 0.6401 0.639
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0273 0.3743 0.722
Brugia malayi Carboxylesterase family protein 0.0049 0.0238 0.0238
Trichomonas vaginalis cGMP-inhibited 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Echinococcus granulosus cAMP and cAMP inhibited cGMP 3'5' cyclic 0.0228 0.3037 0.3016
Plasmodium falciparum GAF domain-related protein, putative 0.0138 0.1642 1
Trichomonas vaginalis cone cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Echinococcus granulosus calcium:calmodulin dependent 3'5' cyclic 0.0273 0.3743 0.3725
Echinococcus multilocularis acetylcholinesterase 0.0287 0.3966 0.3948
Trypanosoma cruzi hypothetical protein, conserved 0.0089 0.0875 0.121
Trichomonas vaginalis conserved hypothetical protein 0.0138 0.1642 0.1615
Brugia malayi GTP-binding regulatory protein Gs alpha-S chain, putative 0.0053 0.0308 0.0308
Trichomonas vaginalis cAMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Loa Loa (eye worm) hypothetical protein 0.044 0.6363 0.6363
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Mycobacterium ulcerans putative regulatory protein 0.0138 0.1642 0.1615
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0305 0.4239 0.4605
Schistosoma mansoni high-affinity cgmp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Mycobacterium ulcerans putative regulatory protein 0.0138 0.1642 0.1615
Schistosoma mansoni camp-specific 35-cyclic phosphodiesterase 0.0089 0.0875 0.0875
Trichomonas vaginalis rod cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Loa Loa (eye worm) hypothetical protein 0.053 0.7758 0.7758
Echinococcus multilocularis para nitrobenzyl esterase 0.0049 0.0238 0.0209
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Loa Loa (eye worm) carboxylesterase 0.0049 0.0238 0.0238
Toxoplasma gondii hypothetical protein 0.0354 0.5006 1
Loa Loa (eye worm) hypothetical protein 0.0287 0.3966 0.3966
Trypanosoma cruzi cAMP specific phosphodiesterase, putative 0.0443 0.6401 1
Echinococcus multilocularis family S9 non peptidase ue (S09 family) 0.0049 0.0238 0.0209
Loa Loa (eye worm) carboxylesterase 0.0287 0.3966 0.3966
Toxoplasma gondii 3'5'-cyclic nucleotide phosphodiesterase domain-containing protein 0.0089 0.0875 0.0904
Echinococcus granulosus dual 3'5' cyclic AMP and GMP phosphodiesterase 0.0443 0.6401 0.639
Echinococcus granulosus cadherin EGF LAG seven pass G type receptor 0.0036 0.0038 0.0009
Loa Loa (eye worm) PDE1B protein 0.0673 1 1
Loa Loa (eye worm) hypothetical protein 0.0287 0.3966 0.3966
Echinococcus granulosus carboxylesterase 5A 0.0287 0.3966 0.3948
Giardia lamblia hypothetical protein 0.0089 0.0875 0.5
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0308 0.0308
Schistosoma mansoni mixed-lineage leukemia protein mll 0.0071 0.0583 0.0583
Loa Loa (eye worm) glutaminase 2 0.0605 0.8927 0.8927
Brugia malayi Probable 3',5'-cyclic phosphodiesterase R153.1, putative 0.0089 0.0875 0.0875
Schistosoma mansoni hypothetical protein 0.0042 0.0131 0.0131
Echinococcus granulosus high affinity cAMP specific 3'5' cyclic 0.0089 0.0875 0.0848
Echinococcus granulosus guanine nucleotide binding protein Gs subunit 0.0053 0.0308 0.0279
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Echinococcus multilocularis acetylcholinesterase 0.0287 0.3966 0.3948
Schistosoma mansoni Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) 0.0053 0.0308 0.0308
Echinococcus multilocularis carboxylesterase 5A 0.0287 0.3966 0.3948
Trichomonas vaginalis conserved hypothetical protein 0.0089 0.0875 0.0733
Trichomonas vaginalis cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis cAMP-specific phosphodiesterase, putative 0.0443 0.6401 0.7092
Trichomonas vaginalis high-affinity cGMP-specific 3,5-cyclic phosphodiesterase, putative 0.0089 0.0875 0.0733

Activities

Activity type Activity value Assay description Source Reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) ChEMBL. No reference
GI50 (functional) -4 PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) 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

Bibliographic References

No literature references available for this target.

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