Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR3 | P29371 | 13/20 | 0.45 |
| ▸ | TACR2 | P21452 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | MMP9 | P14780 | 1/20 | 0.40 |
| ▸ | MMP8 | P22894 | 1/20 | 0.40 |
| ▸ | MMP12 | P39900 | 1/20 | 0.40 |
| ▸ | MMP13 | P45452 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 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 | |
|---|---|---|---|---|
| SCHEMBL15905547 | 0.90 | TACR3 (0.48) | TACR3TACR2MMP3MMP9MMP8 | |
| SCHEMBL15905277 | 0.88 | MAPT (0.41) | CYP2C9CYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL15905403 | 0.88 | MAPT (0.41) | TACR3CYP2C9CYP3A4MEN1KMT2A | |
| SCHEMBL15905397 | 0.86 | MAPT (0.44) | CYP2C9CYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL15905523 | 0.84 | MAPT (0.42) | CYP2C9CYP3A4MEN1KMT2AALDH1A1 | |
| SCHEMBL15905540 | 0.84 | TACR3 (0.46) | TACR3CYP2C9CYP3A4MEN1KMT2A | |
| SCHEMBL15905434 | 0.84 | TACR3 (0.41) | TACR3TACR2CYP2C9CYP3A4MEN1 | |
| SCHEMBL15904954 | 0.83 | MAPT (0.42) | TACR3CYP2C9CYP3A4MEN1KMT2A | |
| SCHEMBL15905148 | 0.83 | MAPT (0.40) | TACR3CYP2C9CYP3A4MEN1KMT2A | |
| SCHEMBL15905412 | 0.83 | ALDH1A1 (0.44) | CYP2C9CYP3A4MEN1KMT2AALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2948450-A1 | METALLOENZYME INHIBITOR COMPOUNDS | Viamet Pharmaceuticals, Inc. (US) | 2015-12-02 | — | — | EP | claimed |
| WO-2014117090-A1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2014-07-31 | — | — | WO | claimed |
| EP-2948450-A1 | METALLOENZYME INHIBITOR COMPOUNDS | Viamet Pharmaceuticals, Inc. (US) | 2015-12-02 | — | — | EP | disclosed |
| WO-2014117090-A1 | METALLOENZYME INHIBITOR COMPOUNDS | VIAMET PHARMACEUTICALS, INC. (US) | 2014-07-31 | — | — | WO | disclosed |