Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | HPGD | P15428 | 1/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.51 |
| ▸ | HTT | P42858 | 1/20 | 0.51 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA2 | P00918 | 3/20 | 0.46 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | CA9 | Q16790 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL2342479 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL1644002 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL30673688 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL498547 | 0.81 | ALDH1A1 (0.55) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL29350373 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| Hydrochloric Acid SCHEMBL11760825 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL4463532 | 0.80 | CA1 (0.70) | ALDH1A1HPGDCA1CA2CA9 | |
| SCHEMBL1279094 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 | |
| SCHEMBL31309573 | 0.80 | CA1 (0.70) | ALDH1A1HPGDCA1CA2CA9 | |
| SCHEMBL7494652 | 0.80 | ALDH1A1 (0.53) | ALDH1A1HPGDSMN1; SMN2HTTSLC40A1 |
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-6521603-B2 | Amide, thioamide, amidine and thioester derivatives containing a benzene, pyridine, thiophene, furan, pyrrole, pyrazole, thiazole or isothiazole ring | MONSANTO TECHNOLOGY LLC | 2003-02-18 | — | — | US | claimed |