Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 3/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.48 |
| ▸ | HTT | P42858 | 3/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.47 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | KDM1A | O60341 | 1/20 | 0.45 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.42 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7963443 | 1.00 | CYP3A4 (0.52) | CYP3A4NPSR1HTTMAPK1USP2 | |
| SCHEMBL8479757 | 0.89 | POLB (0.52) | HTTMAPK1KDM4ESMN1; SMN2MEN1 | |
| SCHEMBL8477434 | 0.89 | MEN1 (0.47) | CYP3A4HTTMAPK1USP2KDM4E | |
| SCHEMBL8079406 | 0.89 | MEN1 (0.47) | CYP3A4HTTMAPK1USP2KDM4E | |
| SCHEMBL7772042 | 0.89 | MEN1 (0.47) | CYP3A4HTTMAPK1USP2KDM4E | |
| SCHEMBL8482072 | 0.88 | ALDH1A1 (0.47) | HTTMAPK1KDM4EMEN1KMT2A | |
| SCHEMBL8479934 | 0.87 | ADRB1 (0.45) | MEN1KMT2ACYP11B1CYP11B2POLB | |
| SCHEMBL8477139 | 0.86 | ALOX5 (0.49) | CYP3A4MAPK1HSD17B10SMN1; SMN2MEN1 | |
| SCHEMBL8480213 | 0.86 | ALOX5 (0.49) | CYP3A4MAPK1HSD17B10SMN1; SMN2MEN1 | |
| SCHEMBL8555360 | 0.83 | NAMPT (0.43) | MEN1KMT2APOLBALDH1A1NAMPT |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6265409-B1 | ANTIINFLAMMATORY AGENTS | ASTRAZENECA AB (SE) | 2001-07-24 | — | — | US | disclosed |
| WO-2000061560-A1 | NOVEL COMPOUNDS | ASTRAZENECA AB (SE) | 2000-10-19 | — | — | WO | disclosed |
| EP-1019375-A1 | NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Astra Pharmaceuticals Limited (GB) | 2000-07-19 | — | — | EP | disclosed |
| WO-1998042669-A1 | NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-10-01 | — | — | WO | disclosed |