Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | bromodomain adjacent to zinc finger domain, 2B | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 19 | Starlite/ChEMBL | No references |
Homo sapiens | glucagon-like peptide 1 receptor | Starlite/ChEMBL | No references |
Homo sapiens | hydroxyprostaglandin dehydrogenase 15-(NAD) | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 9 | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 3, subfamily A, polypeptide 4 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | cytochrome P450 | cytochrome P450, family 3, subfamily A, polypeptide 4 | 502 aa | 492 aa | 24.2 % |
Leishmania major | cytochrome p450-like protein | cytochrome P450, family 2, subfamily C, polypeptide 19 | 490 aa | 411 aa | 23.1 % |
Loa Loa (eye worm) | pigment dispersing factor receptor c | glucagon-like peptide 1 receptor | 463 aa | 388 aa | 25.8 % |
Plasmodium falciparum | steroid dehydrogenase, putative | hydroxyprostaglandin dehydrogenase 15-(NAD) | 266 aa | 216 aa | 22.2 % |
Mycobacterium tuberculosis | Probable cytochrome P450 136 Cyp136 | cytochrome P450, family 2, subfamily C, polypeptide 9 | 490 aa | 441 aa | 21.8 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Echinococcus granulosus | histone lysine methyltransferase setb | 0.0021 | 0.0216 | 0.0291 |
Brugia malayi | PHD-finger family protein | 0.003 | 0.1543 | 0.1543 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0023 | 0.0609 | 0.0656 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.006 | 0.5754 | 0.6202 |
Echinococcus granulosus | methyl CpG binding domain protein 2 | 0.0021 | 0.0216 | 0.0291 |
Schistosoma mansoni | bromodomain containing protein | 0.0076 | 0.8021 | 1 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0059 | 0.5573 | 0.6006 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.006 | 0.5754 | 0.5754 |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.006 | 0.5754 | 0.5754 |
Loa Loa (eye worm) | hypothetical protein | 0.006 | 0.5754 | 0.6202 |
Mycobacterium ulcerans | cytochrome P450 185A4 Cyp185A4 | 0.0023 | 0.0609 | 0.5 |
Echinococcus multilocularis | bromodomain adjacent to zinc finger domain | 0.0072 | 0.7417 | 1 |
Echinococcus multilocularis | zinc finger protein | 0.0024 | 0.0642 | 0.0866 |
Brugia malayi | Bromodomain containing protein | 0.0046 | 0.3803 | 0.3803 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.4215 | 0.4543 |
Trypanosoma cruzi | cytochrome P450, putative | 0.0023 | 0.0609 | 0.5 |
Echinococcus multilocularis | bromodomain adjacent to zinc finger domain | 0.0043 | 0.3404 | 0.4589 |
Loa Loa (eye worm) | hypothetical protein | 0.0021 | 0.0216 | 0.0233 |
Trypanosoma cruzi | cytochrome P450, putative | 0.0023 | 0.0609 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0052 | 0.4538 | 0.4891 |
Schistosoma mansoni | methyl-cpg binding protein mbd | 0.0021 | 0.0216 | 0.0269 |
Schistosoma mansoni | histone-lysine n-methyltransferase setb1 | 0.0021 | 0.0216 | 0.0269 |
Schistosoma mansoni | zinc finger protein | 0.0024 | 0.0642 | 0.08 |
Echinococcus granulosus | bromodomain adjacent to zinc finger domain | 0.0072 | 0.7417 | 1 |
Brugia malayi | Cytochrome P450 family protein | 0.0059 | 0.5573 | 0.5573 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.3091 | 0.3331 |
Loa Loa (eye worm) | PHD-finger family protein | 0.0025 | 0.0821 | 0.0884 |
Echinococcus multilocularis | histone lysine methyltransferase setb histone lysine methyltransferase eggless | 0.0021 | 0.0216 | 0.0291 |
Echinococcus multilocularis | fetal alzheimer antigen, falz | 0.0027 | 0.1143 | 0.1541 |
Brugia malayi | latrophilin 2 splice variant baaae | 0.0041 | 0.3091 | 0.3091 |
Schistosoma mansoni | hypothetical protein | 0.0041 | 0.3091 | 0.3853 |
Brugia malayi | Cytochrome P450 family protein | 0.0023 | 0.0609 | 0.0609 |
Loa Loa (eye worm) | CYP4Cod1 | 0.0023 | 0.0609 | 0.0656 |
Trypanosoma brucei | cytochrome P450, putative | 0.0023 | 0.0609 | 0.5 |
Echinococcus multilocularis | methyl CpG binding domain protein 2 | 0.0021 | 0.0216 | 0.0291 |
Echinococcus granulosus | zinc finger protein | 0.0024 | 0.0642 | 0.0866 |
Echinococcus granulosus | fetal alzheimer antigen falz | 0.0027 | 0.1143 | 0.1541 |
Loa Loa (eye worm) | bromodomain containing protein | 0.0021 | 0.032 | 0.0344 |
Schistosoma mansoni | methyl-cpg binding protein mbd | 0.0021 | 0.0216 | 0.0269 |
Loa Loa (eye worm) | hypothetical protein | 0.0085 | 0.9278 | 1 |
Echinococcus granulosus | bromodomain adjacent to zinc finger domain | 0.0043 | 0.3404 | 0.4589 |
Loa Loa (eye worm) | hypothetical protein | 0.0046 | 0.3815 | 0.4112 |
Leishmania major | cytochrome p450-like protein | 0.0023 | 0.0609 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.0025 | 0.0821 | 0.1023 |
Brugia malayi | Cytochrome P450 family protein | 0.0023 | 0.0609 | 0.0609 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0023 | 0.0609 | 0.0656 |
Schistosoma mansoni | histone-lysine n-methyltransferase setb1 | 0.0021 | 0.0216 | 0.0269 |
Schistosoma mansoni | acetyl-CoA C-acetyltransferase | 0.0027 | 0.1143 | 0.1425 |
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) | = 3.981071706 uM | 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) | = 6.309573445 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 |
AC50 (functional) | = 14.12537545 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) | = 25.11886432 uM | 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 |
Potency (functional) | 0.0329 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) | 2.3323 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) | 11.2202 uM | PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 14.1254 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase). (Class of assay: confirmatory) [Related pubchem assays: 2429 (Confirmation qHTS Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2407 (Probe Development Summary for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase)), 2427 (Thermal Shift Assay for Inhibitors of HPGD (15-Hydroxyprostaglandin Dehydrogenase))] | ChEMBL. | No reference |
Potency (functional) | 15.8489 uM | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of BAZ2B. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504391] | ChEMBL. | No reference |
Potency (functional) | 22.3872 uM | PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] | ChEMBL. | No reference |
Potency (functional) | 22.3872 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) | = 25.1189 um | PUBCHEM_BIOASSAY: qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (without detergent). (Class of assay: confirmatory) [Related pubchem assays: 2158 (Confirmation qHTS Assay for Inhibitors of Cruzain), 2249 (Probe Development Summary of Promiscuous Inhibitors (Artifacts) of Cruzain), 2161 (qHTS Assay for Inhibitors of Papain: Counterscreen for Cruzain Assay), 1478 (qHTS Assay for Promiscuous and Specific Inhibitors of Cruzain (with detergent))] | ChEMBL. | No reference |
Potency (functional) | = 25.1189 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] | ChEMBL. | No reference |
Potency (functional) | 25.1189 uM | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Mammalian Selenoprotein Thioredoxin Reductase 1 (TrxR1): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488771] | ChEMBL. | No reference |
Potency (functional) | 25.1189 uM | PubChem BioAssay. Inhibitors of Secretory Acid Sphingomyelinase (S-ASM): qHTS. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 25.929 uM | PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 29.081 uM | PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] | ChEMBL. | No reference |
Potency (functional) | 31.6228 uM | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] | ChEMBL. | No reference |
Potency (functional) | = 35.4813 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Human Jumonji Domain Containing 2E (JMJD2E). (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 35.4813 uM | PUBCHEM_BIOASSAY: qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493107, AID493125] | 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.