Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.54 |
| ▸ | TSHR | P16473 | 4/20 | 0.54 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.54 |
| ▸ | LMNA | P02545 | 3/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.54 |
| ▸ | MEN1 | O00255 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.54 |
| ▸ | BLM | P54132 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.54 |
| ▸ | ATM | Q13315 | 2/20 | 0.54 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.54 |
| ▸ | GMNN | O75496 | 1/20 | 0.54 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.54 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL463408 | 0.93 | ALDH1A1 (0.53) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| 1,6-Hexanediol SCHEMBL28904411 | 0.87 | ALDH1A1 (0.47) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL28179323 | 0.86 | ALDH1A1 (0.52) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL1598616 | 0.83 | HSPA5 (0.53) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL11318043 | 0.82 | ALDH1A1 (0.58) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| Propionic Acid SCHEMBL17825585 | 0.82 | GAA (0.48) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL463139 | 0.81 | HSPA5 (0.65) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL26328615 | 0.80 | HSPA5 (0.58) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL27683623 | 0.79 | HSPA5 (0.49) | ALDH1A1TSHRMAPK1LMNANPSR1 | |
| SCHEMBL11307397 | 0.78 | ALDH1A1 (0.72) | ALDH1A1TSHRMAPK1LMNANPSR1 |
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-103980686-B | A kind of biodegradable packaging tube material of germ resistance and flexible pipe preparation method thereof | CHENGYI PLASTIC PRODUCTS CO., LTD., SHANGHAI (CN) | 2016-03-23 | — | — | CN | claimed |