Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | NQO1 | P15559 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CA2 | P00918 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | HTR1A | P08908 | 1/20 | 0.37 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL5250993 | 0.80 | CA2 (0.55) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL9046597 | 0.79 | ALDH1A1 (0.56) | ALDH1A1MAPTHPGDKDM4ELMNA | |
| SCHEMBL3507559 | 0.73 | HTR1A (0.49) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL9044071 | 0.72 | APLNR (0.49) | ALDH1A1KDM4ELMNACYP3A4ALOX15 | |
| SCHEMBL3429487 | 0.71 | EGFR (0.51) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL5632559 | 0.69 | ALDH1A1 (0.48) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL505777 | 0.68 | CA1 (0.50) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL11158816 | 0.68 | CA1 (0.50) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL23499986 | 0.67 | CA1 (0.44) | ALDH1A1TP53MAPTHPGDKDM4E | |
| SCHEMBL3728677 | 0.67 | LTA4H (0.52) | ALDH1A1MAPTKDM4EMAPK1CA1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0510526-B1 | Use of sulfonamides as drug and new sulfonamides | HOFFMANN LA ROCHE (CH) | 1996-12-04 | — | — | EP | disclosed |
| US-5270313-A | Treatment of circulatory disorders | HOFFMANN-LA ROCHE INC. (US) | 1993-12-14 | — | — | US | disclosed |
| EP-0510526-A1 | Use of sulfonamides as drug and new sulfonamides | F.HOFFMANN-LA ROCHE & CO. AKTIENGESELLSCHAFT (CH) | 1992-10-28 | — | — | EP | disclosed |