Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PGK1 | P00558 | 2/20 | 0.65 |
| ▸ | PGK2 | P07205 | 2/20 | 0.65 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.48 |
| ▸ | MMP2 | P08253 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.47 |
| ▸ | MMP14 | P50281 | 1/20 | 0.47 |
| ▸ | CA9 | Q16790 | 1/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.47 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.45 |
| ▸ | SRC | P12931 | 1/20 | 0.44 |
| ▸ | FDFT1 | P37268 | 1/20 | 0.43 |
| ▸ | ACP3 | P15309 | 1/20 | 0.42 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9007810 | 0.89 | PGK1 (0.59) | PGK1PGK2PTGS1MEN1CYP2D6 | |
| SCHEMBL9007806 | 0.88 | PGK1 (0.57) | PGK1PGK2PTGS1MEN1CYP2D6 | |
| SCHEMBL9007812 | 0.88 | PGK1 (0.57) | PGK1PGK2PTGS1MEN1CYP2D6 | |
| SCHEMBL9007805 | 0.88 | PGK1 (0.57) | PGK1PGK2PTGS1MEN1CYP2D6 | |
| SCHEMBL8740626 | 0.86 | PGK1 (0.59) | PGK1PGK2PTGS1CYP2D6ACP3 | |
| SCHEMBL9007814 | 0.83 | PGK1 (0.56) | PGK1PGK2PTGS1MMP8MMP14 | |
| SCHEMBL11214240 | 0.83 | PTGS1 (0.55) | PGK1PGK2PTGS1MEN1CYP2D6 | |
| SCHEMBL9007809 | 0.82 | PGK1 (0.54) | PGK1PGK2PTGS1ACP3 | |
| SCHEMBL11046075 | 0.79 | POLB (0.70) | PTGS1MEN1CYP2D6KMT2AALOX5 | |
| SCHEMBL11388011 | 0.79 | PTGS1 (0.57) | PTGS1MEN1CYP2D6KMT2AALOX5 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0746323-A4 | — | — | 1997-01-22 | — | — | EP | disclosed |
| EP-0746323-A1 | INHIBITORS OF PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C | MERCK & CO. INC. (US) | 1996-12-11 | — | — | EP | disclosed |
| US-5519163-A | A-HYDROXYPHOSPHONATE COMPOUNDS | MERCK & CO., INC. (US) | 1996-05-21 | — | — | US | disclosed |
| WO-1995010286-A1 | INHIBITORS OF PHOSPHOINOSITIDE-SPECIFIC PHOSPHOLIPASE C | MERCK & CO., INC. (US) | 1995-04-20 | — | — | WO | disclosed |
| US-4471118-A | Preparation of aldehydes by heating an α-hydroxyphosphonic acid ester | BAYER AKTIENGESELLSCHAFT (DE) | 1984-09-11 | — | — | US | disclosed |