Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSPD1 | P10809 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.34 |
| ▸ | CMA1 | P23946 | 1/20 | 0.34 |
| ▸ | CNR2 | P34972 | 1/20 | 0.34 |
| ▸ | PTGES | O14684 | 4/20 | 0.33 |
| ▸ | ALOX5 | P09917 | 4/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11067677 | 0.85 | TDP1 (0.35) | MEN1KMT2AHSD17B10CA2ALDH1A1 | |
| SCHEMBL11030342 | 0.79 | MAPK1 (0.44) | HSPD1BLMHSPE1MEN1KMT2A | |
| SCHEMBL9720372 | 0.72 | HSPD1 (0.40) | HSPD1BLMHSPE1MEN1KMT2A | |
| SCHEMBL9720361 | 0.72 | HSPD1 (0.40) | HSPD1BLMHSPE1MEN1KMT2A | |
| Ammonia Solution, Strong SCHEMBL9720349 | 0.71 | TBXAS1 (0.39) | HSPD1BLMHSPE1MEN1KMT2A | |
| SCHEMBL9720312 | 0.71 | TBXAS1 (0.50) | POLBTBXAS1 | |
| Ammonia Solution, Strong SCHEMBL9720296 | 0.70 | TBXAS1 (0.49) | POLBTBXAS1 | |
| SCHEMBL27870287 | 0.70 | MAPK1 (0.44) | HSPD1BLMHSPE1MEN1KMT2A | |
| SCHEMBL15518120 | 0.69 | CA2 (0.54) | HSPD1BLMHSPE1MEN1KMT2A | |
| SCHEMBL4958072 | 0.69 | KIF11 (0.45) | KMT2AMAPTPRSS1CTSGCTRB1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5148817-A | Heterocyclic hydroxy-substituted carboxylic compound as flavor additive | PHILIP MORRIS INCORPORATED (US) | 1992-09-22 | — | — | US | disclosed |
| US-4592373-A | Smoking compositions | PHILIP MORRIS INC. (US) | 1986-06-03 | — | — | US | disclosed |
| EP-0052969-A2 | Flavorant compounds, their pyrolysis products, and smoking and food compositions containing them | PHILIP MORRIS INCORPORATED (US) | 1982-06-02 | — | — | EP | disclosed |