Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | TOP1 | P11387 | 2/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.39 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.38 |
| ▸ | CA1 | P00915 | 1/20 | 0.38 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | CA9 | Q16790 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | ERN1 | O75460 | 1/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.36 |
| ▸ | NCF1 | P14598 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Formamide SCHEMBL27359672 | 0.89 | ALDH1A1 (0.50) | ALDH1A1NPC1KDM4EMAPTERN1 | |
| Biphenyl SCHEMBL29127776 | 0.85 | ALDH1A1 (0.52) | ALDH1A1NOTUMNPC1TOP1MAOB | |
| Biphenyl SCHEMBL28549078 | 0.85 | ALDH1A1 (0.52) | ALDH1A1NOTUMNPC1TOP1MAOB | |
| Quinoxaline SCHEMBL1335895 | 0.84 | ALDH1A1 (0.44) | ALDH1A1NPC1KDM4EMAPTERN1 | |
| Quinoline SCHEMBL1337002 | 0.81 | ALDH1A1 (0.74) | ALDH1A1NPC1KDM4EMAPTRAB9A | |
| Biphenyl SCHEMBL3096874 | 0.79 | ALDH1A1 (0.53) | ALDH1A1NOTUMNPC1TOP1PIK3CA | |
| Biphenyl SCHEMBL7723103 | 0.79 | ALDH1A1 (0.60) | ALDH1A1NOTUMCYP2A6CA12CA1 | |
| Benzene SCHEMBL27857732 | 0.76 | ALDH1A1 (0.63) | ALDH1A1NPC1KDM4EMAPTRAB9A | |
| Quinoxaline SCHEMBL28165605 | 0.76 | NOTUM (0.71) | ALDH1A1NOTUMNPC1KDM4EMAPT | |
| Biphenyl SCHEMBL4922682 | 0.76 | ALDH1A1 (0.81) | ALDH1A1NOTUMNPC1TOP1CYP2A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116890555-A | High-temperature-resistant thermosensitive medical film with stable imaging and preparation process thereof | 江苏普仁新材料科技有限公司 | 2023-10-17 | — | — | CN | disclosed |