Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.62 |
| ▸ | CA12 | O43570 | 1/20 | 0.59 |
| ▸ | CA9 | Q16790 | 1/20 | 0.59 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | MAPT | P10636 | 2/20 | 0.53 |
| ▸ | RAB9A | P51151 | 2/20 | 0.51 |
| ▸ | CASP3 | P42574 | 2/20 | 0.48 |
| ▸ | GLS | O94925 | 1/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL8939993 | 0.87 | ALDH1A1 (0.64) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL6699242 | 0.83 | ALDH1A1 (0.64) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL17595505 | 0.83 | MAPK1 (0.59) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL17280822 | 0.83 | ALDH1A1 (0.64) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL3435525 | 0.83 | ALDH1A1 (0.64) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL9157221 | 0.83 | ALDH1A1 (0.59) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL30268729 | 0.82 | MAPK1 (0.58) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL5798482 | 0.82 | MAPK1 (0.58) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL5798484 | 0.82 | MAPK1 (0.58) | ALDH1A1CA12CA9MAPK1KMT2A | |
| SCHEMBL6153732 | 0.82 | MAPK1 (0.58) | ALDH1A1CA12CA9MAPK1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3489236-B1 | PROCESS FOR THE PREPARATION OF FUSED HETEROAROMATIC PYRROLIDINONES | TAKEDA PHARMACEUTICALS CO (JP) | 2020-09-30 | — | — | EP | disclosed |
| WO-2007025940-A1 | SUBSTITUTED BIARYLS AND THEIR USE AS FACTOR XA INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2007-03-08 | — | — | WO | disclosed |
| EP-0259206-B1 | DERIVATIVES OF 1,4-DIHYDROPYRIDINE, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ADIR ET COMPAGNIE (FR) | 1991-10-09 | — | — | EP | disclosed |