Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.45 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | CASP3 | P42574 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.43 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.43 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.43 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | RECQL | P46063 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL31591064 | 1.00 | IDO1 (0.45) | IDO1NPC1RAB9ACASP3SMN1; SMN2 | |
| SCHEMBL3671622 | 1.00 | IDO1 (0.45) | IDO1NPC1RAB9ACASP3SMN1; SMN2 | |
| SCHEMBL25620226 | 0.81 | IDO1 (0.44) | IDO1NPC1RAB9ASMN1; SMN2CTBP2 | |
| SCHEMBL934459 | 0.79 | ESR1 (0.46) | IDO1NPC1RAB9ACTBP2TAAR1 | |
| SCHEMBL467699 | 0.79 | ESR1 (0.46) | IDO1NPC1RAB9ACTBP2TAAR1 | |
| SCHEMBL467700 | 0.79 | ESR1 (0.46) | IDO1NPC1RAB9ACTBP2TAAR1 | |
| SCHEMBL363987 | 0.78 | CYP1A2 (0.45) | IDO1NPC1RAB9ACASP3SMN1; SMN2 | |
| SCHEMBL11400752 | 0.78 | MAOB (0.52) | IDO1CYP1A2CYP2A6TAAR1ALDH1A1 | |
| SCHEMBL5898755 | 0.77 | IDO1 (0.45) | IDO1NPC1RAB9ASMN1; SMN2CTBP2 | |
| SCHEMBL9705002 | 0.77 | TRPA1 (0.47) | IDO1CTBP2TAAR1AGXT |
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-112495141-A | Method and system for collecting tobacco fragrance in flue-cured tobacco leaf tail gas | 云南烟叶复烤有限责任公司 | 2021-03-16 | — | — | CN | disclosed |