Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.73 |
| ▸ | MEN1 | O00255 | 3/20 | 0.73 |
| ▸ | RAB9A | P51151 | 2/20 | 0.73 |
| ▸ | NPC1 | O15118 | 2/20 | 0.73 |
| ▸ | LMNA | P02545 | 1/20 | 0.73 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.71 |
| ▸ | CA1 | P00915 | 3/20 | 0.66 |
| ▸ | CA2 | P00918 | 3/20 | 0.66 |
| ▸ | CA12 | O43570 | 2/20 | 0.66 |
| ▸ | CA9 | Q16790 | 2/20 | 0.66 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.66 |
| ▸ | GAA | P10253 | 1/20 | 0.66 |
| ▸ | MAPT | P10636 | 1/20 | 0.66 |
| ▸ | ERCC1 | P07992 | 2/20 | 0.65 |
| ▸ | ERCC4 | Q92889 | 2/20 | 0.65 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.65 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.65 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.65 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.65 |
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 | |
|---|---|---|---|---|
| SCHEMBL5860896 | 1.00 | ALDH1A1 (0.73) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL16082991 | 0.93 | ALDH1A1 (0.83) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL392625 | 0.89 | ALDH1A1 (0.82) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL22664696 | 0.86 | MEN1 (0.74) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL24821237 | 0.85 | KMT2A (0.77) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL14758329 | 0.84 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL10133256 | 0.84 | ALDH1A1 (0.75) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL3838048 | 0.84 | ALDH1A1 (0.75) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL10133036 | 0.84 | ALDH1A1 (1.00) | ALDH1A1KMT2AMEN1RAB9ANPC1 | |
| SCHEMBL17229250 | 0.83 | PLAAT3 (0.73) | ALDH1A1KMT2AMEN1LMNAL3MBTL1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112209847-B | Method for preparing amide compound under catalysis of ionic liquid in high-pressure environment | 烟台大学 | 2022-12-23 | — | — | CN | disclosed |
| CN-112209847-A | Method for preparing amide compound under catalysis of ionic liquid in high-pressure environment | 烟台大学 | 2021-01-12 | — | — | CN | disclosed |
| CN-107790186-B | Novel decamethyl cyclopentadienyl zirconium complex and preparation method and application thereof | 山西医科大学 | 2020-10-30 | — | — | CN | disclosed |
| EP-0810220-B1 | Arylacrylamide derivatives as 5HT1 agonists or antagonists | PFIZER (US) | 2001-12-12 | — | — | EP | disclosed |
| US-6258953-B1 | Arylacrylamide derivatives | PFIZER INC. | 2001-07-10 | — | — | US | disclosed |
| EP-0810220-A1 | Arylacrylamide derivatives as 5HT1 agonists or antagonists | PFIZER INC. (US) | 1997-12-03 | — | — | EP | disclosed |