Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.35 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.35 |
| ▸ | MMP8 | P22894 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL12245354 | 0.93 | MEN1 (0.45) | MEN1KMT2ACYP4F2CYP4A11MMP8 | |
| SCHEMBL15043137 | 0.88 | MEN1 (0.40) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL11110959 | 0.86 | MEN1 (0.41) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL12336899 | 0.86 | MEN1 (0.41) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL22070907 | 0.85 | CYP4F2 (0.49) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL2142127 | 0.84 | CYP4F2 (0.51) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL22070687 | 0.84 | CYP4F2 (0.51) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL86959 | 0.82 | PKM (0.38) | MEN1KMT2ACYP4F2CYP4A11ADORA3 | |
| SCHEMBL28887798 | 0.82 | CYP4F2 (0.55) | MEN1KMT2ACYP4F2CYP4A11KDM4C | |
| SCHEMBL25331145 | 0.80 | MEN1 (0.44) | MEN1KMT2ACYP4F2CYP4A11KDM4C |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4487929-A | HYPOTENSIVE AGENTS | HOFFMANN-LA ROCHE, INC. (US) | 1984-12-11 | — | — | US | disclosed |
| US-4399136-A | Pyrazolopyridazine antihypertensives | HOFFMANN-LA ROCHE INC. (US) | 1983-08-16 | — | — | US | disclosed |
| EP-0042100-A1 | Pyrazolopyridazine derivatives, intermediates and processes for their preparation, and medicaments containing them | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1981-12-23 | — | — | EP | disclosed |