Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.45 |
| ▸ | ESR2 | Q92731 | 5/20 | 0.40 |
| ▸ | ESR1 | P03372 | 3/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | ANPEP | P15144 | 1/20 | 0.39 |
| ▸ | DPP4 | P27487 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | PKMYT1 | Q99640 | 4/20 | 0.37 |
| ▸ | EPHB3 | P54753 | 2/20 | 0.37 |
| ▸ | EPHA3 | P29320 | 1/20 | 0.37 |
| ▸ | WEE1 | P30291 | 1/20 | 0.37 |
| ▸ | EPHB4 | P54760 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL23685619 | 0.83 | ESR2 (0.51) | ACHEESR2ESR1CYP1A2CYP2C19 | |
| SCHEMBL29827105 | 0.78 | HSD17B10 (0.48) | CYP1A2CYP2C19TSHRLMNAALDH1A1 | |
| SCHEMBL5270640 | 0.78 | HSD17B10 (0.48) | CYP1A2CYP2C19TSHRLMNAALDH1A1 | |
| SCHEMBL10915039 | 0.75 | ALDH1A1 (0.57) | CYP1A2CYP2C19ANPEPDPP4CYP3A4 | |
| SCHEMBL10813949 | 0.75 | CYP1A2 (0.39) | CYP1A2CYP2C19CYP3A4RECQLLMNA | |
| SCHEMBL11039827 | 0.72 | KDM4E (0.43) | ACHECYP1A2CYP2C19TSHREPHB4 | |
| SCHEMBL20816319 | 0.71 | ALDH1A1 (0.56) | ESR2ESR1CYP1A2CYP2C19CYP3A4 | |
| SCHEMBL1126941 | 0.70 | CYP1A2 (0.61) | ACHECYP1A2CYP2C19TSHRLMNA | |
| SCHEMBL7827414 | 0.70 | ALDH1A1 (0.53) | TSHRLMNAALDH1A1KDM4EGAA | |
| SCHEMBL12154627 | 0.69 | PKMYT1 (0.42) | ESR2CYP1A2CYP2C19CYP3A4PKMYT1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4451462-A | Method of treating inflammation and pain using heteramino benzofurans | CIBA-GEIGY CORPORATION (US) | 1984-05-29 | — | — | US | disclosed |
| EP-0107620-A1 | Phenol derivatives | CIBA-GEIGY AG (CH) | 1984-05-02 | — | — | EP | disclosed |
| US-4426380-A | ANTIINFLAMMATORY, ANALGESIC, SUNSCREEN | CIBA-GEIGY CORPORATION (US) | 1984-01-17 | — | — | US | disclosed |
| EP-0082109-A2 | Substituted 2-hydroxyphenylacetic acids and derivatives of them | CIBA-GEIGY AG (CH) | 1983-06-22 | — | — | EP | disclosed |
| EP-0078241-A2 | Furanes | CIBA-GEIGY AG (CH) | 1983-05-04 | — | — | EP | disclosed |