Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TRPM8 | Q7Z2W7 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.41 |
| ▸ | RELA | Q04206 | 1/20 | 0.41 |
| ▸ | CES2 | O00748 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | CA12 | O43570 | 1/20 | 0.39 |
| ▸ | CA9 | Q16790 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL11297916 | 0.87 | NPSR1 (0.43) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL2546393 | 0.82 | L3MBTL1 (0.51) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL11252915 | 0.79 | ALDH1A1 (0.38) | ALDH1A1NPSR1HPGDNPC1RAB9A | |
| SCHEMBL3918384 | 0.77 | PKM (0.39) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL9353496 | 0.76 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2ANPSR1HPGD | |
| SCHEMBL11298575 | 0.75 | MEN1 (0.37) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL4654046 | 0.75 | NPSR1 (0.43) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL23367901 | 0.73 | CA12 (0.43) | ALDH1A1MEN1KMT2ANPSR1MAPT | |
| SCHEMBL5136604 | 0.71 | LMNA (0.40) | ALDH1A1MEN1KMT2ANPSR1LMNA | |
| SCHEMBL3986442 | 0.71 | AKT1 (0.38) | ALDH1A1KMT2ANPSR1MAPTTRPM8 |
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-4311647-A | Process for preparation of (hydrocarbonthio)oxamides | THE B. F. GOODRICH COMPANY (US) | 1982-01-19 | — | — | US | disclosed |