Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.58 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.55 |
| ▸ | LPL | P06858 | 1/20 | 0.55 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | ATM | Q13315 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | PLAU | P00749 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.48 |
| ▸ | MGLL | Q99685 | 2/20 | 0.46 |
| ▸ | IDO1 | P14902 | 2/20 | 0.46 |
| ▸ | PLK1 | P53350 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL36295 | 0.96 | TP53 (0.67) | TP53TAAR1CYP2A6LPLLIPG | |
| Ammonia Solution, Strong SCHEMBL27293386 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| Hydrogen Sulfide SCHEMBL27925242 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL27756675 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL7542835 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| Hydrogen Sulfide SCHEMBL29290777 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL31498555 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| SCHEMBL27339836 | 0.92 | TP53 (0.62) | TP53TAAR1CYP2A6LPLLIPG | |
| Hydrochloric Acid SCHEMBL25251831 | 0.88 | TP53 (0.59) | TP53TAAR1CYP2A6LPLLIPG | |
| Hydrogen Peroxide SCHEMBL28370411 | 0.88 | TP53 (0.69) | TP53TAAR1CYP2A6LPLLIPG |
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-107001221-A | method for preparing treprostinil | 奇诺因药物和化学工厂私人有限公司 | 2017-08-01 | — | — | CN | disclosed |