Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.46 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.43 |
| ▸ | GRM5 | P41594 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | ELANE | P08246 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8341619 | 0.99 | CASP3 (0.45) | CASP3CA12CA9KMT2APTGS2 | |
| SCHEMBL23748222 | 0.78 | CASP3 (0.47) | CASP3CA12CA9KMT2AGRM5 | |
| SCHEMBL5112475 | 0.76 | PTGS2 (0.46) | PTGS2CYP3A4ALDH1A1 | |
| SCHEMBL5983552 | 0.76 | PTGS2 (0.46) | PTGS2CYP3A4ALDH1A1 | |
| SCHEMBL30222272 | 0.76 | PTGS2 (0.46) | PTGS2CYP3A4ALDH1A1 | |
| SCHEMBL23748314 | 0.75 | CASP3 (0.47) | CASP3CA12CA9KMT2AGRM5 | |
| SCHEMBL3213661 | 0.74 | CASP3 (0.49) | CASP3CA12CA9KMT2AGRM5 | |
| SCHEMBL7987177 | 0.74 | CASP3 (0.49) | CASP3CA12CA9KMT2AGRM5 | |
| SCHEMBL7822153 | 0.74 | PTGS2 (0.44) | KMT2APTGS2MEN1CYP1A2GAA | |
| SCHEMBL1063487 | 0.74 | PTGS2 (0.44) | KMT2APTGS2CYP3A4ALDH1A1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5902803-A | 5H,10H-imidazo 1,2-a!indeno 1,2-e!pyrazin-4-one derivatives, preparation thereof, and drugs containing said derivatives | RHONE-POULENC RORER S.A. (FR) | 1999-05-11 | — | — | US | disclosed |