Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 3/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.45 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.45 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA9 | Q16790 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.40 |
| ▸ | EGLN2 | Q96KS0 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL31757929 | 1.00 | KIF11 (0.46) | KIF11MMP3MAP4K4ALDH1A1CYP2A6 | |
| SCHEMBL21388680 | 0.85 | ALDH1A1 (0.65) | KIF11MMP3MAP4K4ALDH1A1CYP2A6 | |
| SCHEMBL29502034 | 0.84 | ALDH1A1 (0.50) | ALDH1A1CYP2A6TDP1CYP3A4CASP1 | |
| SCHEMBL178452 | 0.84 | ALDH1A1 (0.50) | ALDH1A1CYP2A6TDP1CYP3A4CASP1 | |
| Hydrochloric Acid SCHEMBL6476027 | 0.82 | ALDH1A1 (0.48) | ALDH1A1CYP2A6TDP1CYP3A4CASP1 | |
| SCHEMBL10304732 | 0.82 | KIF11 (0.50) | KIF11MMP3MAP4K4ALDH1A1CYP2A6 | |
| SCHEMBL15156687 | 0.82 | TDP1 (0.61) | KIF11MMP3MAP4K4ALDH1A1CYP2A6 | |
| SCHEMBL29655663 | 0.82 | TDP1 (0.61) | KIF11MMP3MAP4K4ALDH1A1CYP2A6 | |
| SCHEMBL6866139 | 0.81 | CYP3A4 (0.62) | ALDH1A1TDP1CYP3A4CASP1TSHR | |
| SCHEMBL31661348 | 0.81 | CYP3A4 (0.62) | ALDH1A1TDP1CYP3A4CASP1TSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2010085968-A1 | TOLUIDINE SULFONAMIDES AND THEIR USE AS HIF-INHIBITORS | EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) | 2010-08-05 | — | — | WO | disclosed |
| WO-2010076034-A1 | TOLUIDINE SULFONAMIDES AND THEIR USE AS-INHIBITORS | EUROPEAN MOLECULAR BIOLOGY LABORATORY (EMBL) (DE) | 2010-07-08 | — | — | WO | disclosed |