Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPM5 | Q9NZQ8 | 1/20 | 0.69 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.55 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.55 |
| ▸ | MAPT | P10636 | 1/20 | 0.55 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.55 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.52 |
| ▸ | ATM | Q13315 | 2/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.50 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.49 |
| ▸ | BACE1 | P56817 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.48 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL28796994 | 0.85 | MAPT (0.58) | TRPM5CYP3A4CYP2D6MAPTCYP2C9 | |
| SCHEMBL28796967 | 0.85 | MAPT (0.58) | TRPM5CYP3A4CYP2D6MAPTCYP2C9 | |
| SCHEMBL27882241 | 0.82 | KMT2A (0.66) | CYP3A4CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL31612234 | 0.81 | TRPM5 (1.00) | TRPM5CYP3A4MAPTCYP2C9CYP2C19 | |
| SCHEMBL3861202 | 0.81 | TRPM5 (1.00) | TRPM5CYP3A4MAPTCYP2C9CYP2C19 | |
| SCHEMBL3861198 | 0.81 | TRPM5 (1.00) | TRPM5CYP3A4MAPTCYP2C9CYP2C19 | |
| SCHEMBL27865858 | 0.75 | CYP3A4 (0.70) | CYP3A4CYP2D6MAPTCYP2C9CYP2C19 | |
| SCHEMBL4253934 | 0.74 | PTPN1 (0.73) | TRPM5CYP3A4MAPTCYP2C19ATM | |
| SCHEMBL9050603 | 0.73 | L3MBTL1 (0.61) | TRPM5CYP3A4CYP2D6MAPTCYP2C19 | |
| SCHEMBL3855392 | 0.73 | BACE1 (0.74) | CYP3A4CYP2D6MAPTCYP2C9CYP2C19 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102603553-B | Compound with collaborative antifungal effect and application thereof in pharmaceuticals | UNIV PLA 2ND MILITARY MEDICAL | 2014-07-30 | — | — | CN | disclosed |