Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | CA12 | O43570 | 1/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3310787 | 0.86 | ALDH1A1 (0.41) | ALDH1A1CA12CA9 | |
| SCHEMBL9624015 | 0.83 | DNM1 (0.43) | ALDH1A1TSHR | |
| SCHEMBL9792595 | 0.81 | ALDH1A1 (0.33) | ALDH1A1TSHR | |
| SCHEMBL3314937 | 0.80 | ALDH1A1 (0.32) | ALDH1A1TSHR | |
| SCHEMBL28197223 | 0.78 | CA12 (0.36) | ALDH1A1CA12CA2CA9TSHR | |
| SCHEMBL5253602 | 0.73 | CA12 (0.43) | ALDH1A1CA12CA9TSHR | |
| SCHEMBL7526100 | 0.72 | CA12 (0.50) | ALDH1A1CA12CA2CA9TSHR | |
| SCHEMBL14617689 | 0.72 | ALDH1A1 (0.39) | ALDH1A1CA12CA2CA9TSHR | |
| SCHEMBL28790113 | 0.68 | CA12 (0.36) | ALDH1A1CA12CA2CA9TSHR | |
| SCHEMBL1670173 | 0.68 | CA12 (0.36) | ALDH1A1CA12CA2CA9TSHR |
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 |
|---|---|---|---|---|---|---|---|
| EP-0405785-A2 | Catalysts | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-02 | — | — | EP | disclosed |