Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.52 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | CACNA1H | O95180 | 5/20 | 0.44 |
| ▸ | EGLN2 | Q96KS0 | 1/20 | 0.44 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | CTSS | P25774 | 1/20 | 0.42 |
| ▸ | CTSK | P43235 | 1/20 | 0.42 |
| ▸ | NQO2 | P16083 | 1/20 | 0.41 |
| ▸ | DAO | P14920 | 1/20 | 0.41 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL27549593 | 0.89 | TRPA1 (0.47) | TRPA1CA1CA2CACNA1HEGLN2 | |
| SCHEMBL30751832 | 0.88 | CTSS (0.47) | TRPA1EGLN2CTSSCTSKNQO2 | |
| SCHEMBL21266053 | 0.88 | CTSS (0.47) | TRPA1EGLN2CTSSCTSKNQO2 | |
| SCHEMBL6928939 | 0.88 | TRPA1 (0.54) | TRPA1CACNA1HEGLN2NAMPTCTSS | |
| SCHEMBL13171671 | 0.86 | NSD2 (0.46) | TRPA1CA1CA2CACNA1HNAMPT | |
| SCHEMBL31432911 | 0.85 | CA1 (0.48) | CA1CA2CACNA1HAAK1MAPT | |
| SCHEMBL7933824 | 0.84 | TRPA1 (0.46) | TRPA1CACNA1HEGLN2CTSSCTSK | |
| SCHEMBL31432797 | 0.84 | CA1 (0.47) | CA1CA2CACNA1HMAPT | |
| SCHEMBL16822026 | 0.84 | KCNJ1 (0.43) | TRPA1CA1CA2NAMPTCTSS | |
| SCHEMBL5106289 | 0.84 | CA1 (0.41) | TRPA1CA1CA2NAMPTCTSS |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018089433-A1 | PHENYL mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |
| WO-2018089433-A1 | PHENYL mTORC INHIBITORS AND USES THEREOF | NAVITOR PHARMACEUTICALS, INC. (US) | 2018-05-17 | — | — | WO | disclosed |