Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 14/20 | 0.64 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.64 |
| ▸ | THRB | P10828 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | FYN | P06241 | 2/20 | 0.41 |
| ▸ | CYP51A1 | Q16850 | 2/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.41 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL74247 | 0.88 | CYP3A4 (0.74) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| SCHEMBL10594823 | 0.81 | CYP3A4 (0.65) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| SCHEMBL10910788 | 0.80 | CYP3A4 (0.59) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| SCHEMBL10910566 | 0.80 | CYP3A4 (0.59) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| Azaconazole SCHEMBL21056 | 0.80 | CYP3A4 (0.69) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| Azaconazole SCHEMBL29354903 | 0.80 | CYP3A4 (0.69) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| Azaconazole SCHEMBL3009257 | 0.80 | CYP3A4 (0.69) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| SCHEMBL9521231 | 0.80 | CYP3A4 (0.41) | CYP3A4CYP2C9THRBSLC6A2SLC6A4 | |
| SCHEMBL11134303 | 0.80 | CYP3A4 (0.64) | CYP3A4CYP2C9THRBKDM4ESLC6A2 | |
| SCHEMBL10512062 | 0.80 | CYP3A4 (0.64) | CYP3A4CYP2C9THRBKDM4ESLC6A2 |
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-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 |