Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 3/20 | 0.39 |
| ▸ | CYP4F2 | P78329 | 2/20 | 0.39 |
| ▸ | CYP4A11 | Q02928 | 2/20 | 0.39 |
| ▸ | THRB | P10828 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL457731 | 0.98 | PKM (0.40) | PKMCYP4F2CYP4A11THRBHTT | |
| Water SCHEMBL10546251 | 0.96 | MEN1 (0.40) | PKMCYP4F2CYP4A11THRBHTT | |
| Trifluoroacetic Acid SCHEMBL9068008 | 0.90 | CYP4F2 (0.36) | PKMCYP4F2CYP4A11THRBHTT | |
| SCHEMBL13807718 | 0.83 | SOAT1 (0.42) | PKMCYP4F2CYP4A11THRBHTT | |
| SCHEMBL1979744 | 0.82 | ALDH1A1 (0.48) | PKMCYP4F2CYP4A11THRBHTT | |
| SCHEMBL6320646 | 0.82 | CES2 (0.35) | ALDH1A1MEN1KMT2ALMNAHSD17B10 | |
| SCHEMBL6327476 | 0.81 | ALDH1A1 (0.47) | THRBALDH1A1 | |
| SCHEMBL6328254 | 0.80 | ALDH1A1 (0.46) | CYP4F2CYP4A11THRBALDH1A1 | |
| SCHEMBL7914245 | 0.79 | CYP4F2 (0.39) | PKMCYP4F2CYP4A11THRBHTT | |
| SCHEMBL6718702 | 0.79 | MMP8 (0.44) | PKMCYP4F2CYP4A11THRBHTT |
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 |
|---|---|---|---|---|---|---|---|
| US-5750550-A | RESPIRATORY SYSTEM DISORDERS | SANOFI (FR) | 1998-05-12 | — | — | US | disclosed |
| WO-1997010243-A1 | 2-(PYRAZOL-5-YL-OXYMETHYL)-1,2-BENZISOTHIAZOL-3(2H)-ONE 1,1-DIOXIDES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | SANOFI (US) | 1997-03-20 | — | — | WO | disclosed |