Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.67 |
| ▸ | THPO | P40225 | 2/20 | 0.67 |
| ▸ | MTOR | P42345 | 2/20 | 0.67 |
| ▸ | MEN1 | O00255 | 3/20 | 0.66 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.66 |
| ▸ | PMP22 | Q01453 | 2/20 | 0.66 |
| ▸ | SLC29A1 | Q99808 | 6/20 | 0.65 |
| ▸ | SCN1A | P35498 | 2/20 | 0.64 |
| ▸ | SCN2A | Q99250 | 2/20 | 0.64 |
| ▸ | SCN3A | Q9NY46 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.59 |
| ▸ | ABCC4 | O15439 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL9680837 | 0.87 | CYP3A4 (0.73) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL9681943 | 0.87 | CYP3A4 (0.73) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL9680878 | 0.87 | CYP3A4 (0.73) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL27318922 | 0.86 | SCN1A (0.59) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL7952909 | 0.85 | CYP3A4 (0.67) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL27519173 | 0.85 | CYP3A4 (0.71) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL18675943 | 0.85 | SLC29A1 (0.68) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL11493947 | 0.84 | SLC29A1 (0.67) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL7956555 | 0.84 | SLC29A1 (0.67) | CYP3A4CYP2D6THPOMTORMEN1 | |
| SCHEMBL11219537 | 0.83 | SCN1A (0.69) | CYP3A4CYP2D6THPOMTORMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5962453-A | HEPATITIS THERAPY | NIPPON SHINYAKU CO. LTD. (JP) | 1999-10-05 | — | — | US | disclosed |
| EP-0775487-A1 | TRIAZINE DERIVATIVE AND MEDICINE | NIPPON SHINYAKU COMPANY, LIMITED (JP) | 1997-05-28 | — | — | EP | disclosed |