Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 9/20 | 0.51 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 5/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.51 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.51 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.51 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.51 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.51 |
| ▸ | CYP51A1 | Q16850 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | OGG1 | O15527 | 1/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8057057 | 0.92 | CYP3A4 (0.59) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL11119666 | 0.88 | CYP3A4 (0.52) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9308406 | 0.87 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10713754 | 0.87 | CYP3A4 (0.51) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10434458 | 0.86 | CYP3A4 (0.50) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9862475 | 0.85 | LMNA (0.48) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL9862671 | 0.85 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL8757356 | 0.85 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL2435556 | 0.85 | CYP3A4 (0.49) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 | |
| SCHEMBL10850684 | 0.85 | CYP3A4 (0.47) | CYP3A4CYP2C9CYP2C19LMNAHSP90AA1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5360813-A | Inhibitors of ergosterol biosynthesis | J. URIACH & CIA. S.A. (ES) | 1994-11-01 | — | — | US | disclosed |
| US-5344839-A | Imidazole or triazole compounds | J. URIACH & CIA. S.A. (ES) | 1994-09-06 | — | — | US | disclosed |
| EP-0480215-A1 | New sulfonamides as antifungal agents | J. URIACH & CIA. S.A. (ES) | 1992-04-15 | — | — | EP | disclosed |
| EP-0097469-B1 | TRIAZOLE ANTIFUNGAL AGENTS | Pfizer Limited (GB) | 1986-10-15 | — | — | EP | disclosed |
| US-4482558-A | Antifungal amide and urea derivatives of (3-amino-2-aryl-2-hydroxyprop-1-yl)-1H-1,2,4-triazoles | PFIZER INC. (US) | 1984-11-13 | — | — | US | disclosed |
| EP-0097469-A2 | Triazole antifungal agents | Pfizer Limited (GB) | 1984-01-04 | — | — | EP | disclosed |