Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | HTT | P42858 | 1/20 | 0.58 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.58 |
| ▸ | MAPT | P10636 | 9/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | GLA | P06280 | 1/20 | 0.48 |
| ▸ | EGFR | P00533 | 1/20 | 0.47 |
| ▸ | GALR3 | O60755 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | S100A4 | P26447 | 1/20 | 0.45 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL30018445 | 1.00 | ALDH1A1 (0.58) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL1844442 | 0.85 | MAPT (0.47) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL12491825 | 0.82 | CYP19A1 (0.52) | ALDH1A1KDM4EHTTHCAR3EGFR | |
| SCHEMBL17309819 | 0.81 | ALDH3A1 (0.63) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL29250635 | 0.80 | HCAR3 (0.50) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL7808225 | 0.79 | ALDH1A1 (0.60) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL2036709 | 0.79 | TSHR (0.62) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL595478 | 0.79 | ALDH1A1 (0.68) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL30660990 | 0.79 | ALDH1A1 (0.68) | ALDH1A1KDM4EHTTHCAR3MAPT | |
| SCHEMBL16538184 | 0.78 | HTT (0.54) | ALDH1A1KDM4EHTTHCAR3MAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-112358760-A | Preparation method of anti-corrosion wear-resistant surface material | 嘉兴市轩禾园艺技术有限公司 | 2021-02-12 | — | — | CN | disclosed |
| WO-2005016883-A2 | ACRYLAMIDE DERIVATIVES AS VLA-1 INTEGRIN ANTAGONISTS AND USES THEREOF | ICOS CORPORATION (US) | 2005-02-24 | — | — | WO | disclosed |