Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | GNAS complex locus | Starlite/ChEMBL | No references |
Homo sapiens | TAR DNA binding protein | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 19 | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 9 | Starlite/ChEMBL | No references |
Homo sapiens | glucagon-like peptide 1 receptor | Starlite/ChEMBL | No references |
Homo sapiens | nuclear factor, erythroid 2-like 2 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Loa Loa (eye worm) | pigment dispersing factor receptor c | glucagon-like peptide 1 receptor | 463 aa | 388 aa | 25.8 % |
Mycobacterium tuberculosis | Probable cytochrome P450 136 Cyp136 | cytochrome P450, family 2, subfamily C, polypeptide 9 | 490 aa | 441 aa | 21.8 % |
Leishmania major | cytochrome p450-like protein | cytochrome P450, family 2, subfamily C, polypeptide 19 | 490 aa | 411 aa | 23.1 % |
Schistosoma mansoni | GTP-binding protein alpha subunit gna | GNAS complex locus | 394 aa | 450 aa | 28.7 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Echinococcus multilocularis | beta tubulin | 0.0064 | 0.6509 | 0.6267 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0055 | 0.3985 | 0.3568 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.006 | 0.5389 | 0.5389 |
Toxoplasma gondii | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | GTP-binding regulatory protein Gs alpha-S chain, putative | 0.0055 | 0.3985 | 0.3985 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.006 | 0.5389 | 0.5389 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0055 | 0.3985 | 0.3985 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Echinococcus multilocularis | tubulin beta 1 chain | 0.0064 | 0.6509 | 0.6267 |
Echinococcus multilocularis | tar DNA binding protein | 0.0076 | 1 | 1 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0055 | 0.3985 | 0.3985 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Echinococcus granulosus | beta tubulin | 0.0064 | 0.6509 | 0.6267 |
Echinococcus granulosus | tar DNA binding protein | 0.0076 | 1 | 1 |
Loa Loa (eye worm) | RNA recognition domain-containing protein domain-containing protein | 0.0076 | 1 | 1 |
Schistosoma mansoni | tar DNA-binding protein | 0.0076 | 1 | 1 |
Loa Loa (eye worm) | RNA binding protein | 0.0076 | 1 | 1 |
Schistosoma mansoni | tar DNA-binding protein | 0.0076 | 1 | 1 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Trypanosoma brucei | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | hypothetical protein | 0.0043 | 0.0649 | 0.0649 |
Echinococcus granulosus | tubulin subunit beta | 0.0064 | 0.6509 | 0.6267 |
Loa Loa (eye worm) | BEN-1 protein | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | hypothetical protein | 0.0043 | 0.0649 | 0.0649 |
Toxoplasma gondii | beta-1 tubulin, putative | 0.0064 | 0.6509 | 0.5 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0055 | 0.3985 | 0.3985 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0055 | 0.3985 | 0.3568 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0055 | 0.3985 | 0.3568 |
Loa Loa (eye worm) | hypothetical protein | 0.006 | 0.5389 | 0.5389 |
Echinococcus granulosus | tubulin beta 4A class IVa | 0.0064 | 0.6509 | 0.6267 |
Giardia lamblia | Beta tubulin | 0.0064 | 0.6509 | 0.5 |
Trypanosoma brucei | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Giardia lamblia | Beta tubulin | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | RNA recognition motif domain containing protein | 0.0076 | 1 | 1 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Echinococcus multilocularis | beta tubulin | 0.0064 | 0.6509 | 0.6267 |
Loa Loa (eye worm) | beta-tubulin | 0.0064 | 0.6509 | 0.6509 |
Trichomonas vaginalis | tubulin epsilon chain, putative | 0.0064 | 0.6509 | 0.5 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Giardia lamblia | Beta tubulin | 0.0064 | 0.6509 | 0.5 |
Toxoplasma gondii | beta-tubulin, putative | 0.0064 | 0.6509 | 0.5 |
Trypanosoma brucei | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Entamoeba histolytica | tubulin family protein | 0.0064 | 0.6509 | 1 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | tar DNA-binding protein | 0.0076 | 1 | 1 |
Loa Loa (eye worm) | TAR-binding protein | 0.0076 | 1 | 1 |
Plasmodium vivax | tubulin beta chain, putative | 0.0064 | 0.6509 | 0.5 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | tar DNA-binding protein | 0.0076 | 1 | 1 |
Loa Loa (eye worm) | GTP-binding regulatory protein Gs alpha-S chain | 0.0055 | 0.3985 | 0.3985 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Schistosoma mansoni | transcription factor LCR-F1 | 0.0043 | 0.0649 | 0.0649 |
Trichomonas vaginalis | tubulin epsilon chain, putative | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Trichomonas vaginalis | tubulin, putative | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | beta-tubulin, identical | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Schistosoma mansoni | tar DNA-binding protein | 0.0076 | 1 | 1 |
Trypanosoma brucei | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Loa Loa (eye worm) | tubulin beta-4 chain | 0.0064 | 0.6509 | 0.6509 |
Plasmodium falciparum | tubulin beta chain | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Trichomonas vaginalis | tubulin beta chain, putative | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0055 | 0.3813 | 0.3813 |
Brugia malayi | TAR-binding protein | 0.0076 | 1 | 1 |
Trichomonas vaginalis | tubulin gamma chain, putative | 0.0064 | 0.6509 | 0.5 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0055 | 0.3985 | 0.3568 |
Loa Loa (eye worm) | BEN-1 protein | 0.0064 | 0.6509 | 0.6509 |
Trypanosoma cruzi | beta tubulin, putative | 0.0064 | 0.6509 | 0.5 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Entamoeba histolytica | tubulin family protein | 0.0064 | 0.6509 | 1 |
Echinococcus multilocularis | tubulin subunit beta | 0.0064 | 0.6509 | 0.6267 |
Echinococcus granulosus | beta tubulin | 0.0064 | 0.6509 | 0.6267 |
Loa Loa (eye worm) | tubulin beta chain | 0.0064 | 0.6509 | 0.6509 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Echinococcus multilocularis | tubulin, beta 4A class IVa | 0.0064 | 0.6509 | 0.6267 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Schistosoma mansoni | tubulin subunit beta | 0.0064 | 0.6509 | 0.6509 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Trichomonas vaginalis | tubulin alpha chain, putative | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | Tubulin beta-1 chain | 0.0064 | 0.6509 | 0.6509 |
Echinococcus granulosus | tubulin beta 1 chain | 0.0064 | 0.6509 | 0.6267 |
Brugia malayi | Cytochrome P450 family protein | 0.0055 | 0.3813 | 0.3813 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Loa Loa (eye worm) | tubulin beta-2A chain | 0.0064 | 0.6509 | 0.6509 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0064 | 0.6509 | 0.6267 |
Loa Loa (eye worm) | tubulin beta-1 chain | 0.0064 | 0.6509 | 0.6509 |
Leishmania major | beta tubulin | 0.0064 | 0.6509 | 0.5 |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.006 | 0.5389 | 0.5389 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | = 5.623413252 uM | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference |
AC50 (functional) | = 12.58925412 uM | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference |
Potency (functional) | 3.6964 uM | PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] | ChEMBL. | No reference |
Potency (functional) | 6.3096 uM | PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 6.3096 uM | PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 11.2202 uM | PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 14.7157 uM | PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] | ChEMBL. | No reference |
Potency (functional) | 18.3564 uM | PUBCHEM_BIOASSAY: Nrf2 qHTS screen for inhibitors. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493153, AID493163, AID504648] | ChEMBL. | No reference |
Potency (functional) | 35.4813 uM | PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b: Cytotox Counterscreen. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588855, AID588860] | ChEMBL. | No reference |
Potency (functional) | 50.1187 uM | PubChem BioAssay. qHTS for Inhibitors of ATXN expression. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 100 uM | PUBCHEM_BIOASSAY: qHTS for Inhibitors of Polymerase Iota. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588623] | ChEMBL. | No reference |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Plasmodium falciparum | ChEMBL23 |
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.