Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.40 |
| ▸ | GAA | P10253 | 5/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | GSR | P00390 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 3/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | GMNN | O75496 | 1/20 | 0.36 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | BLM | P54132 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL9124269 | 0.81 | VCAM1 (0.33) | ALDH1A1GAATDP1PTGS1PTGS2 | |
| SCHEMBL9841770 | 0.77 | ALDH1A1 (0.40) | ALDH1A1GAATDP1GSRCA2 | |
| SCHEMBL9841907 | 0.75 | ALDH1A1 (0.42) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL9124434 | 0.74 | ALDH1A1 (0.43) | ALDH1A1GAATDP1CA2CA1 | |
| SCHEMBL9455580 | 0.73 | ALOX5 (0.36) | ALDH1A1GAATDP1GSRCA2 | |
| SCHEMBL18459329 | 0.72 | CA2 (0.61) | ALDH1A1GAATDP1GSRCA2 | |
| SCHEMBL9646024 | 0.70 | GAA (0.40) | ALDH1A1GAATDP1GSRCA2 | |
| Hydrochloric Acid SCHEMBL9647760 | 0.69 | GAA (0.39) | ALDH1A1GAATDP1GSRNFKB1 | |
| SCHEMBL14800758 | 0.68 | KMO (0.46) | LMNAMEN1KMT2AMAPTHTT | |
| SCHEMBL9842095 | 0.68 | MKNK1 (0.41) | ALDH1A1GAATDP1CA2CA1 |
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-5059598-A | Antiinflammatory agents; lipoxygenase inhibitors; arthritis; asthma | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1991-10-22 | — | — | US | disclosed |
| US-4868183-A | ANTIINFLAMMATORY, ENZYME INHIBITORS | OTSUKA PHARMACEUTICAL FACTORY, INC. (JP) | 1989-09-19 | — | — | US | disclosed |