Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 8/20 | 0.56 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.56 |
| ▸ | XIAP | P98170 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | XBP1 | P17861 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | MYC | P01106 | 1/20 | 0.35 |
| ▸ | WDR5 | P61964 | 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 | |
|---|---|---|---|---|
| SCHEMBL11565385 | 0.84 | PTGS2 (0.74) | PTGS2PTGS1KDM4EMAPTLMNA | |
| SCHEMBL11563598 | 0.83 | PTGS2 (0.56) | PTGS2PTGS1KDM4EMAPTLMNA | |
| SCHEMBL11564670 | 0.82 | PTGS2 (0.55) | PTGS2PTGS1XIAPKDM4EMAPT | |
| SCHEMBL31070141 | 0.81 | MAPT (0.45) | PTGS2PTGS1KDM4EMAPTSMN1; SMN2 | |
| Itazigrel SCHEMBL564056 | 0.80 | PTGS2 (0.57) | PTGS2PTGS1KDM4EMAPTLMNA | |
| SCHEMBL11565287 | 0.75 | PTGS2 (0.52) | PTGS2PTGS1KDM4EMAPTLMNA | |
| SCHEMBL11561600 | 0.74 | PTGS2 (0.51) | PTGS2PTGS1XIAPKDM4EMAPT | |
| SCHEMBL7839874 | 0.74 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL7845809 | 0.74 | PTGS2 (0.64) | PTGS2PTGS1 | |
| SCHEMBL11756287 | 0.73 | PTGS2 (0.48) | PTGS2XIAPKDM4EMAPTLMNA |
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-4168315-A | ANTICOAGULANTS | THE UPJOHN COMPANY (US) | 1979-09-18 | — | — | US | disclosed |