Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | NLRP3 | Q96P20 | 12/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.58 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | MAPT | P10636 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | NPC1 | O15118 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL5142374 | 0.88 | ALDH1A1 (0.66) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL7093999 | 0.85 | ALDH1A1 (0.58) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL6360996 | 0.83 | RAB9A (0.69) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL11403762 | 0.83 | NLRP3 (0.62) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL30675594 | 0.83 | NLRP3 (0.62) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL14202768 | 0.83 | ALDH1A1 (0.59) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL441932 | 0.83 | HDAC4 (0.67) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL127182 | 0.83 | CA1 (0.61) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL4602459 | 0.83 | NLRP3 (0.62) | ALDH1A1CYP1A2NLRP3MEN1KMT2A | |
| SCHEMBL439465 | 0.83 | HDAC4 (0.71) | ALDH1A1CYP1A2NLRP3MEN1KMT2A |
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-5026731-A | 2,5-dihydroxyalkanoyl anilides | SCHERING CORPORATION (US) | 1991-06-25 | — | — | US | disclosed |