Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CASP3 | P42574 | 1/20 | 0.54 |
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | CA4 | P22748 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | RAB9A | P51151 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.46 |
| ▸ | APAF1 | O14727 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4245809 | 0.85 | ACHE (0.71) | ACHEALDH1A1GAAKMT2AHSD17B10 | |
| SCHEMBL21609729 | 0.82 | ACHE (0.59) | ACHEALDH1A1HPGD | |
| SCHEMBL21609732 | 0.82 | ACHE (0.59) | ACHEALDH1A1HPGD | |
| SCHEMBL17117470 | 0.82 | ACHE (0.59) | ACHEALDH1A1HPGD | |
| SCHEMBL14450985 | 0.81 | ACHE (0.57) | ACHEALDH1A1TDP1L3MBTL1HPGD | |
| SCHEMBL17031430 | 0.81 | RAB9A (0.55) | ACHENPSR1ALDH1A1MAPTRAB9A | |
| SCHEMBL29263737 | 0.79 | HPGD (0.59) | ACHEALDH1A1TDP1L3MBTL1HPGD | |
| SCHEMBL29671486 | 0.78 | ACHE (0.58) | ACHEALDH1A1MAPTHSD17B10HPGD | |
| SCHEMBL28702049 | 0.78 | ACHE (0.58) | ACHEALDH1A1MAPTHSD17B10HPGD | |
| SCHEMBL9762447 | 0.78 | CASP3 (0.48) | CASP3CA1CA2CA4CA9 |
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-5034381-A | Antagonist | CIBA-GEIGY CORPORATION (US) | 1991-07-23 | — | — | US | disclosed |
| EP-0323807-A2 | Certain 2-substituted adenosine derivatives | CIBA-GEIGY AG (CH) | 1989-07-12 | — | — | EP | disclosed |