Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITGB3 | P05106 | 2/20 | 0.39 |
| ▸ | ITGAV | P06756 | 2/20 | 0.39 |
| ▸ | GPR139 | Q6DWJ6 | 3/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.37 |
| ▸ | CTSA | P10619 | 3/20 | 0.37 |
| ▸ | ITGB1 | P05556 | 1/20 | 0.37 |
| ▸ | ITGA4 | P13612 | 1/20 | 0.37 |
| ▸ | HCRTR1 | O43613 | 3/20 | 0.36 |
| ▸ | HCRTR2 | O43614 | 3/20 | 0.36 |
| ▸ | WDR5 | P61964 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | MMP12 | P39900 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL687232 | 0.89 | CTSA (0.46) | CTSAKDM4EALDH1A1 | |
| SCHEMBL27762465 | 0.88 | CTSA (0.38) | MAPTCYP1A2CYP2C9CYP2C19PTGER3 | |
| SCHEMBL688156 | 0.87 | PTGER3 (0.41) | MAPTCYP1A2CYP2C9CYP2C19PTGER3 | |
| SCHEMBL688306 | 0.86 | MAPT (0.51) | ITGB3ITGAVMAPTPTGER3ITGB1 | |
| SCHEMBL687289 | 0.85 | CTSA (0.41) | MAPTCYP1A2CYP2C9CYP2C19PTGER3 | |
| SCHEMBL687335 | 0.83 | CTSA (0.43) | CTSA | |
| SCHEMBL688377 | 0.83 | LMNA (0.42) | ITGB3ITGAVITGB1ITGA4WDR5 | |
| SCHEMBL27568502 | 0.83 | POLB (0.41) | MAPTCYP1A2CYP2C9CYP2C19PTGER3 | |
| SCHEMBL27568504 | 0.83 | POLB (0.41) | MAPTCYP1A2CYP2C9CYP2C19PTGER3 | |
| SCHEMBL688172 | 0.82 | MAPT (0.41) | MAPTCTSAITGB1ITGA4KDM4E |
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 |