Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CHRNB4 | P30926 | 11/20 | 0.47 |
| ▸ | CHRNA3 | P32297 | 11/20 | 0.47 |
| ▸ | CHRNA7 | P36544 | 2/20 | 0.40 |
| ▸ | CHRNB2 | P17787 | 3/20 | 0.34 |
| ▸ | CHRNA4 | P43681 | 3/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL30354465 | 0.79 | ALDH1A1 (0.56) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL29150796 | 0.79 | ALDH1A1 (0.56) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL24322363 | 0.79 | ALDH1A1 (0.51) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL2045328 | 0.78 | CHRNB4 (0.57) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL16098695 | 0.72 | CHRNB4 (0.66) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL29740319 | 0.71 | CYP19A1 (0.44) | ALDH1A1CHRNB2CHRNA4CYP19A1 | |
| SCHEMBL19253727 | 0.71 | CHRNB4 (0.63) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL24414772 | 0.69 | CHRNB4 (0.55) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL4693339 | 0.69 | CHRNB4 (0.55) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 | |
| SCHEMBL27928338 | 0.69 | CHRNB4 (0.55) | ALDH1A1CYP1A2THRBCYP2C19CHRNB4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4119671-A1 | METHOD FOR SYNTHESIZING (S)-NICOTINE | Porton Pharma Solutions Ltd. (CN) | 2023-01-18 | — | — | EP | disclosed |
| WO-2021212880-A1 | METHOD FOR ASYMMETRICALLY PREPARING NICOTINE | 凯特立斯（深圳）科技有限公司 (CN) | 2021-10-28 | — | — | WO | disclosed |