Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 3/20 | 0.43 |
| ▸ | CES2 | O00748 | 1/20 | 0.38 |
| ▸ | EPHX2 | P34913 | 4/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.33 |
| ▸ | RAD52 | P43351 | 1/20 | 0.33 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9246825 | 1.00 | GBA1 (0.43) | GBA1CES2EPHX2TSHRMAPK1 | |
| SCHEMBL9250532 | 0.78 | GBA1 (0.42) | GBA1EPHX2 | |
| SCHEMBL9243674 | 0.78 | GBA1 (0.42) | GBA1EPHX2 | |
| SCHEMBL8717990 | 0.77 | GBA1 (0.44) | GBA1 | |
| SCHEMBL9248113 | 0.77 | GBA1 (0.44) | GBA1 | |
| SCHEMBL9567721 | 0.76 | HTR2C (0.41) | GBA1EPHX2MAPK1LMNAMAPT | |
| SCHEMBL9567708 | 0.75 | EPHX2 (0.36) | GBA1EPHX2 | |
| SCHEMBL9567713 | 0.75 | EPHX2 (0.36) | GBA1EPHX2 | |
| SCHEMBL9241761 | 0.74 | GBA1 (0.37) | GBA1EPHX2 | |
| SCHEMBL9241766 | 0.74 | GBA1 (0.37) | GBA1EPHX2 |
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-5449785-A | Fungicides with triazole groups | HOFFMANN-LA ROCHE INC. (US) | 1995-09-12 | — | — | US | disclosed |
| EP-0524439-A1 | Novel cyclohexane and tetrahydropyran derivatives and antifungal compositions containing these derivatives | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1993-01-27 | — | — | EP | disclosed |