Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | PYGL | P06737 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.34 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.34 |
| ▸ | CTSA | P10619 | 3/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.33 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.33 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | LCK | P06239 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL686989 | 0.94 | SMN1; SMN2 (0.38) | KDM4EALDH1A1FFAR1CYP2C9CYP2C19 | |
| SCHEMBL688501 | 0.93 | SMN1; SMN2 (0.40) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 | |
| SCHEMBL686996 | 0.92 | P2RX3 (0.35) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 | |
| SCHEMBL687688 | 0.91 | SMN1; SMN2 (0.37) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 | |
| SCHEMBL688167 | 0.91 | SMN1; SMN2 (0.43) | KDM4EALDH1A1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL687744 | 0.91 | PTGER3 (0.43) | FFAR1NPSR1RXFP1SLC22A12CTSA | |
| SCHEMBL688946 | 0.91 | SMN1; SMN2 (0.34) | KDM4EALDH1A1FFAR1CYP2C9CYP2C19 | |
| SCHEMBL688507 | 0.90 | SMN1; SMN2 (0.38) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 | |
| SCHEMBL687802 | 0.89 | CTSA (0.34) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 | |
| SCHEMBL687119 | 0.89 | SMN1; SMN2 (0.36) | KDM4EALDH1A1FFAR1CYP3A4CYP2C9 |
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 |