Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | CA1 | P00915 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 2/20 | 0.44 |
| ▸ | CA12 | O43570 | 1/20 | 0.44 |
| ▸ | CA9 | Q16790 | 1/20 | 0.44 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 6/20 | 0.43 |
| ▸ | MMP2 | P08253 | 2/20 | 0.43 |
| ▸ | MMP1 | P03956 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | APEX1 | P27695 | 1/20 | 0.41 |
| ▸ | MMP3 | P08254 | 1/20 | 0.41 |
| ▸ | MMP8 | P22894 | 1/20 | 0.41 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.39 |
| ▸ | ITGA1 | P56199 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL2739644 | 0.87 | CA1 (0.56) | ALDH1A1HPGDCA1CA2CA12 | |
| Benzophenone SCHEMBL28069122 | 0.81 | ALDH1A1 (0.56) | ALDH1A1HPGDCA1CA2CA12 | |
| SCHEMBL2739640 | 0.81 | ALDH1A1 (0.40) | ALDH1A1HPGDCA1CA2CA12 | |
| SCHEMBL3282737 | 0.81 | HPGD (0.69) | ALDH1A1HPGDSRD5A2MEN1KMT2A | |
| SCHEMBL385623 | 0.79 | ALDH1A1 (0.67) | ALDH1A1HPGDSRD5A2MEN1KMT2A | |
| SCHEMBL21506865 | 0.79 | ALDH1A1 (0.67) | ALDH1A1HPGDSRD5A2MEN1KMT2A | |
| SCHEMBL17324199 | 0.79 | CA12 (0.51) | ALDH1A1HPGDCA1CA2CA12 | |
| SCHEMBL195111 | 0.78 | AKR1C3 (0.41) | ALDH1A1HPGDCA1CA2CA12 | |
| SCHEMBL17828245 | 0.77 | ALDH1A1 (0.67) | ALDH1A1HPGDSRD5A2MEN1KMT2A | |
| SCHEMBL6787662 | 0.77 | ALDH1A1 (0.67) | ALDH1A1HPGDSRD5A2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| JP-2004018502-A | [4-(TRIBROMOMETHYLSULFONYL)PHENYL][4-(PHENYLTHIO)PHENYL]METHANONE AND ITS PRODUCTION METHOD | SUMITOMO SEIKA CHEM CO LTD | 2004-01-22 | — | — | JP | disclosed |