Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP19A1 | P11511 | 5/20 | 0.43 |
| ▸ | ESR1 | P03372 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.41 |
| ▸ | PGR | P06401 | 1/20 | 0.41 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.41 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 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 | |
|---|---|---|---|---|
| SCHEMBL10925658 | 0.87 | CYP3A4 (0.40) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10929181 | 0.85 | ALDH1A1 (0.38) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10928222 | 0.85 | ALDH1A1 (0.38) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10926841 | 0.84 | RAB9A (0.47) | ESR1CYP3A4ALDH1A1LMNATP53 | |
| SCHEMBL10929321 | 0.82 | ALDH1A1 (0.53) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10925794 | 0.82 | CYP19A1 (0.42) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10926225 | 0.81 | ESR1 (0.53) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL10928082 | 0.80 | ALDH1A1 (0.35) | ESR1CYP3A4ALDH1A1LMNATP53 | |
| SCHEMBL10930079 | 0.80 | CYP1A2 (0.55) | CYP19A1ESR1CYP3A4ALDH1A1LMNA | |
| SCHEMBL11319941 | 0.80 | ALOX15 (0.67) | CYP19A1ESR1CYP3A4ALDH1A1LMNA |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4518607-A | FUNGICIDES, BACXTERICIDES AND ANTIPROTOZOA AGENTS | SYNTEX (U.S.A.) INC. (US) | 1985-05-21 | — | — | US | disclosed |