Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 1/20 | 0.53 |
| ▸ | ADH1C | P00326 | 1/20 | 0.53 |
| ▸ | ADH1A | P07327 | 1/20 | 0.53 |
| ▸ | ADH7 | P40394 | 1/20 | 0.53 |
| ▸ | NOS1 | P29475 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | EGFR | P00533 | 1/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | MEF2D | Q14814 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8750958 | 0.81 | ADH1B (0.71) | ADH1BADH1CADH1AADH7ALDH1A1 | |
| SCHEMBL10061631 | 0.78 | NOS1 (0.50) | NOS1HDAC1HDAC6EGFRHDAC4 | |
| SCHEMBL1295097 | 0.78 | HDAC1 (0.46) | NOS1HDAC1HDAC6HDAC4MEF2D | |
| SCHEMBL3306932 | 0.78 | ADH1B (0.55) | ADH1BADH1CADH1AADH7NOS1 | |
| SCHEMBL13680779 | 0.77 | CNR1 (0.44) | NOS1HDAC1HDAC6HDAC4MEF2D | |
| SCHEMBL5542783 | 0.77 | ADH1B (0.59) | ADH1BADH1CADH1AADH7HDAC1 | |
| SCHEMBL3306896 | 0.77 | ADH1B (0.59) | ADH1BADH1CADH1AADH7ALDH1A1 | |
| SCHEMBL14219016 | 0.77 | ADH1B (0.59) | ADH1BADH1CADH1AADH7NOS1 | |
| SCHEMBL16527266 | 0.75 | HDAC1 (0.51) | NOS1HDAC1HDAC6HDAC4MEF2D | |
| SCHEMBL12134661 | 0.74 | NOS1 (0.47) | NOS1HDAC1HDAC6EGFRHDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | claimed |