Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | F2 | P00734 | 2/20 | 0.53 |
| ▸ | MMP2 | P08253 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | ITGA4 | P13612 | 5/20 | 0.42 |
| ▸ | ITGB7 | P26010 | 5/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.42 |
| ▸ | SPPL2A | Q8TCT8 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL1548337 | 0.99 | F2 (0.53) | F2MMP2CA1CA2ITGA4 | |
| SCHEMBL29913761 | 0.92 | F2 (0.48) | F2MMP2CA1CA2ITGA4 | |
| SCHEMBL9041127 | 0.86 | ITGA4 (0.43) | F2MMP2CA1CA2ITGA4 | |
| SCHEMBL8178414 | 0.86 | F2 (0.54) | F2CA2ALDH1A1SPPL2A | |
| SCHEMBL6526561 | 0.86 | NPC1 (0.42) | CA1CA2ITGA4ITGB7CYP1A2 | |
| Hydrochloric Acid SCHEMBL6129685 | 0.83 | F2 (0.50) | F2MMP2ALDH1A1SPPL2ACYP19A1 | |
| SCHEMBL6708363 | 0.83 | ITGA4 (0.40) | ITGA4ITGB7CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL5074480 | 0.82 | F2 (0.66) | F2MMP2CA1CA2ALDH1A1 | |
| SCHEMBL6529744 | 0.78 | ITGA4 (0.44) | CA1CA2ITGA4ITGB7NPC1 | |
| SCHEMBL30718534 | 0.78 | F2 (0.49) | F2CA2ALDH1A1SPPL2ASMN1; SMN2 |
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-1893565-A1 | PROCESS AND COMPOUND | NPIL Pharmaceuticals (UK) Ltd (GB) | 2008-03-05 | — | — | EP | disclosed |
| WO-2006131757-A1 | PROCESS AND COMPOUND | NPIL PHARMACEUTICALS (UK) LTD (GB) | 2006-12-14 | — | — | WO | disclosed |