Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | NOS3 | P29474 | 3/20 | 0.36 |
| ▸ | NOS1 | P29475 | 3/20 | 0.36 |
| ▸ | NOS2 | P35228 | 3/20 | 0.36 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.35 |
| ▸ | CA4 | P22748 | 1/20 | 0.35 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL10744962 | 0.96 | CYP1A2 (0.45) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL6130373 | 0.93 | CYP1A2 (0.39) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL6130374 | 0.93 | CYP1A2 (0.39) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL6130376 | 0.93 | CYP1A2 (0.39) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL6130378 | 0.93 | CYP1A2 (0.39) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL132919 | 0.93 | CYP1A2 (0.39) | CYP1A2ACHENOS3NOS1NOS2 | |
| SCHEMBL16191036 | 0.84 | CYP1A2 (0.44) | CYP1A2ACHESIGMAR1L3MBTL1 | |
| Bicarbonate SCHEMBL10608473 | 0.84 | CA12 (0.34) | CYP1A2CA1CA2CA4CHRNA7 | |
| SCHEMBL2907203 | 0.83 | — | — | |
| SCHEMBL29065443 | 0.83 | CYP1A2 (0.52) | CYP1A2NOS3NOS1NOS2CA1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116272256-A | Method and device for collecting tobacco fragrance in redried tobacco tail gas | 云南烟叶复烤有限责任公司 | 2023-06-23 | — | — | CN | disclosed |
| 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 |