Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | PRSS1 | P07477 | 8/20 | 0.39 |
| ▸ | MAPT | P10636 | 4/20 | 0.39 |
| ▸ | F2 | P00734 | 2/20 | 0.38 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.38 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.38 |
| ▸ | TMPRSS6 | Q8IU80 | 2/20 | 0.38 |
| ▸ | ST14 | Q9Y5Y6 | 2/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9127906 | 0.88 | ABL1 (0.46) | ALDH1A1ABL1MAPTCYP1A2CYP3A4 | |
| SCHEMBL9549344 | 0.87 | ALDH1A1 (0.37) | ALDH1A1ABL1PRSS1MAPTF2 | |
| SCHEMBL9124505 | 0.83 | AR (0.39) | ALDH1A1ABL1MAPTHTTCYP1A2 | |
| SCHEMBL9549400 | 0.70 | ALDH1A1 (0.42) | ALDH1A1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL6908940 | 0.69 | ALDH1A1 (0.33) | ALDH1A1MAPT | |
| SCHEMBL9124814 | 0.69 | TSHR (0.38) | ALDH1A1MAPTCYP3A4 | |
| SCHEMBL9343683 | 0.64 | ALDH1A1 (0.59) | ALDH1A1MAPTHTTCYP1A2CYP3A4 | |
| SCHEMBL34107 | 0.64 | PRSS1 (0.54) | ALDH1A1PRSS1MAPTF2PRSS2 | |
| SCHEMBL6369975 | 0.63 | ALDH1A1 (0.56) | ALDH1A1ABL1PRSS1MAPTF2 | |
| SCHEMBL7764821 | 0.63 | ALDH1A1 (0.71) | ALDH1A1ABL1MAPTHTTCYP1A2 |
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-5274135-A | Aminating in the presence of a metal-containing catalyst | THE DOW CHEMICAL COMPANY (US) | 1993-12-28 | — | — | US | disclosed |