Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KEAP1 | Q14145 | 2/20 | 0.39 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | ITGB3 | P05106 | 11/20 | 0.36 |
| ▸ | ITGAV | P06756 | 11/20 | 0.36 |
| ▸ | ITGB5 | P18084 | 5/20 | 0.35 |
| ▸ | ITGB6 | P18564 | 5/20 | 0.35 |
| ▸ | ITGB8 | P26012 | 5/20 | 0.35 |
| ▸ | HPGD | P15428 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.33 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL686847 | 0.91 | CTSA (0.40) | MEN1KMT2AITGB3ITGAVITGB5 | |
| SCHEMBL687910 | 0.91 | MEN1 (0.39) | KEAP1NFE2L2MEN1KMT2AITGB3 | |
| SCHEMBL688106 | 0.91 | KMT2A (0.41) | MEN1KMT2AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL687363 | 0.90 | MEN1 (0.41) | KEAP1NFE2L2MEN1KMT2AHPGD | |
| SCHEMBL686898 | 0.89 | MEN1 (0.39) | MEN1KMT2AITGB3ITGAVHPGD | |
| SCHEMBL688454 | 0.89 | MEN1 (0.41) | KEAP1NFE2L2MEN1KMT2AITGB3 | |
| SCHEMBL687372 | 0.89 | MEN1 (0.40) | MEN1KMT2AITGB3ITGAVHPGD | |
| SCHEMBL687452 | 0.89 | KMT2A (0.38) | MEN1KMT2AHPGDALDH1A1SMN1; SMN2 | |
| SCHEMBL687271 | 0.88 | KMT2A (0.39) | MEN1KMT2AITGB3ITGAVHPGD | |
| SCHEMBL687500 | 0.88 | SMN1; SMN2 (0.37) | MEN1KMT2AITGB3ITGAVHPGD |
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-1203766-B1 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | ENCYSIVE PHARMACEUTICALS INC (US) | 2012-02-29 | — | — | EP | disclosed |
| EP-1203766-A2 | Carboxylic acid derivatives that inhibit the binding of integrins to their receptors | TEXAS BIOTECHNOLOGY CORPORATION (US) | 2002-05-08 | — | — | EP | disclosed |