Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 6/20 | 0.45 |
| ▸ | THRA | P10827 | 2/20 | 0.42 |
| ▸ | THRB | P10828 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 3/20 | 0.37 |
| ▸ | USP2 | O75604 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.37 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.37 |
| ▸ | HSPA5 | P11021 | 1/20 | 0.37 |
| ▸ | IDO1 | P14902 | 1/20 | 0.37 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.37 |
| ▸ | CASP1 | P29466 | 1/20 | 0.37 |
| ▸ | BLM | P54132 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7589686 | 0.91 | CYP3A4 (0.44) | CYP3A4THRATHRBKMT2AALOX15 | |
| SCHEMBL7582260 | 0.88 | CYP3A4 (0.42) | CYP3A4THRATHRBLMNASMN1; SMN2 | |
| SCHEMBL7587071 | 0.87 | CYP3A4 (0.42) | CYP3A4THRATHRBKMT2ALMNA | |
| SCHEMBL7583539 | 0.87 | CYP3A4 (0.42) | CYP3A4THRATHRBMEN1KMT2A | |
| SCHEMBL7585660 | 0.84 | ADRB2 (0.44) | CYP3A4MEN1KMT2ALMNAMAPT | |
| SCHEMBL7583097 | 0.83 | ALDH1A1 (0.41) | CYP3A4USP2LMNAMAPTSMN1; SMN2 | |
| SCHEMBL7590797 | 0.81 | L3MBTL1 (0.40) | CYP3A4THRAUSP2MAPTHTT | |
| SCHEMBL7584283 | 0.80 | GAA (0.40) | CYP3A4THRBCYP2C9KDM4EALDH1A1 | |
| SCHEMBL7585620 | 0.80 | CYP3A4 (0.55) | CYP3A4POLB | |
| SCHEMBL7584819 | 0.77 | ADRB2 (0.39) | CYP3A4MEN1KMT2AMAPTHPGD |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0810218-B1 | 6-Benzyl-2H-pyridazin-3-one derivatives,their preparation and their use as inhibitors of prostaglandin G/H synthase I and II (COX I and COX II) | HOFFMANN LA ROCHE (CH) | 2002-12-04 | — | — | EP | disclosed |
| EP-0810218-A1 | 6-Benzyl-2H-pyridazin-3-one derivatives,their preparation and their use as inhibitors of prostaglandin G/H synthase I and II (COX I and COX II) | F. HOFFMANN-LA ROCHE AG (CH) | 1997-12-03 | — | — | EP | disclosed |