Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOTUM | Q6P988 | 1/20 | 0.56 |
| ▸ | RPA1 | P27694 | 1/20 | 0.53 |
| ▸ | IDO1 | P14902 | 1/20 | 0.51 |
| ▸ | ADH5 | P11766 | 5/20 | 0.50 |
| ▸ | XDH | P47989 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | KMO | O15229 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.45 |
| ▸ | ADH1B | P00325 | 1/20 | 0.45 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL13113375 | 0.80 | KMO (0.67) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL15650149 | 0.79 | LMNA (0.61) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL13113058 | 0.76 | RPA1 (0.58) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL20755444 | 0.76 | NOTUM (0.47) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL20756130 | 0.73 | ADH5 (0.67) | RPA1ADH5XDHLMNAMAPT | |
| SCHEMBL20743776 | 0.73 | PFKFB3 (0.52) | NOTUMRPA1IDO1XDH | |
| SCHEMBL30309709 | 0.73 | PFKFB3 (0.52) | NOTUMRPA1IDO1XDH | |
| SCHEMBL14893373 | 0.72 | NOTUM (0.60) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL21941743 | 0.72 | NOTUM (0.60) | NOTUMRPA1IDO1ADH5XDH | |
| SCHEMBL20365025 | 0.72 | NOTUM (0.60) | NOTUMRPA1IDO1ADH5XDH |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3668856-B1 | NOVEL TETRAZOLE COMPOUNDS AND THEIR USE IN THE TREATMENT OF TUBERCULOSIS | GLAXOSMITHKLINE IP DEV LTD (GB) | 2021-06-23 | — | — | EP | disclosed |
| WO-2019034729-A1 | NOVEL TETRAZOLE COMPOUNDS AND THEIR USE IN THE TREATMENT OF TUBERCULOSIS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2019-02-21 | — | — | WO | disclosed |