Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 2/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | MMP3 | P08254 | 2/20 | 0.46 |
| ▸ | PTPN1 | P18031 | 3/20 | 0.45 |
| ▸ | PLA2G4B | P0C869 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 2/20 | 0.42 |
| ▸ | CA2 | P00918 | 2/20 | 0.42 |
| ▸ | MMP2 | P08253 | 2/20 | 0.42 |
| ▸ | CA9 | Q16790 | 2/20 | 0.42 |
| ▸ | THRA | P10827 | 1/20 | 0.42 |
| ▸ | THRB | P10828 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 2/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.42 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9172031 | 0.89 | PLA2G2A (0.73) | PLA2G2ABLMMMP3PLA2G4BTHRA | |
| SCHEMBL9168532 | 0.86 | PLA2G2A (0.74) | PLA2G2ABLMTHRATHRBTSHR | |
| SCHEMBL9169153 | 0.84 | PLA2G2A (0.56) | PLA2G2ABLMMMP3PLA2G4BTHRA | |
| SCHEMBL9170245 | 0.84 | PLA2G2A (0.58) | PLA2G2ABLMPLA2G4BTSHRTP53 | |
| SCHEMBL9171634 | 0.82 | PLA2G2A (0.85) | PLA2G2ABLMPLA2G4BTHRATHRB | |
| SCHEMBL9325310 | 0.81 | PLA2G2A (0.52) | PLA2G2AMMP3PLA2G4BNPC1RAB9A | |
| SCHEMBL9168070 | 0.81 | PLA2G2A (0.66) | PLA2G2ABLMTHRATHRB | |
| SCHEMBL9171261 | 0.79 | PLA2G2A (0.64) | PLA2G2ABLM | |
| SCHEMBL9167296 | 0.79 | PLA2G2A (0.64) | PLA2G2ABLM | |
| SCHEMBL9169041 | 0.79 | PLA2G2A (0.59) | PLA2G2ABLMNPC1RAB9A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5446189-A | Diester intermediates for diacid enzyme inhibitor | HOFFMANN-LA ROCHE INC. (US) | 1995-08-29 | — | — | US | disclosed |
| US-5324747-A | Treatment of inflammatory diseases | HOFFMANN-LA ROCHE INC. (US) | 1994-06-28 | — | — | US | disclosed |
| EP-0579066-A2 | N-substituted anilines | F. HOFFMANN-LA ROCHE AG (CH) | 1994-01-19 | — | — | EP | disclosed |