Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HMGB1 | P09429 | 2/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALB | P02768 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | HNF4A | P41235 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA1 | P00915 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | CA4 | P22748 | 1/20 | 0.39 |
| ▸ | CA6 | P23280 | 1/20 | 0.39 |
| ▸ | CA7 | P43166 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | NAPRT | Q6XQN6 | 1/20 | 0.39 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.39 |
| ▸ | G6PD | P11413 | 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 | |
|---|---|---|---|---|
| SCHEMBL2998912 | 0.87 | HNF4A (0.49) | HMGB1ALDH1A1KDM4EHPGDALB | |
| SCHEMBL3000318 | 0.87 | HNF4A (0.49) | HMGB1ALDH1A1KDM4EHPGDALB | |
| SCHEMBL2960866 | 0.85 | TP53 (0.50) | HMGB1ALDH1A1KDM4EHPGDTSHR | |
| SCHEMBL5149418 | 0.85 | HMGB1 (0.56) | HMGB1ALDH1A1KDM4EHPGDALB | |
| SCHEMBL1913566 | 0.83 | HSD17B10 (0.51) | ALDH1A1KDM4EHPGDHSD17B10TSHR | |
| SCHEMBL5314231 | 0.79 | HMGB1 (0.56) | HMGB1ALDH1A1KDM4EHPGDALB | |
| SCHEMBL1651395 | 0.79 | CYBB (0.41) | ALDH1A1TSHRCA12CA1CA2 | |
| SCHEMBL27581275 | 0.79 | KDM4E (0.52) | HMGB1ALDH1A1KDM4EHPGDHSD17B10 | |
| SCHEMBL3000319 | 0.79 | HNF4A (0.42) | HMGB1ALDH1A1KDM4EHPGDHNF4A | |
| SCHEMBL619112 | 0.78 | HMGB1 (0.59) | HMGB1ALDH1A1KDM4EHPGDALB |
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 |
|---|---|---|---|---|---|---|---|
| EP-1339665-A1 | NITRODERIVATIVES AS DRUGS FOR DISEASES HAVING AN INFLAMMATORY BASIS | Nicox S.A. (FR) | 2003-09-03 | — | — | EP | disclosed |
| WO-2002030866-A1 | NITRODERIVATIVES AS DRUGS FOR DISEASES HAVING AN INFLAMMATORY BASIS | NICOX S.A. (FR) | 2002-04-18 | — | — | WO | disclosed |