Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TBXAS1 | P24557 | 1/20 | 0.47 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.42 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.42 |
| ▸ | ITGAV | P06756 | 3/20 | 0.42 |
| ▸ | ITGA2B | P08514 | 2/20 | 0.42 |
| ▸ | GRM8 | O00222 | 1/20 | 0.42 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HRH1 | P35367 | 3/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 3/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.40 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL29963731 | 1.00 | TBXAS1 (0.47) | TBXAS1CYP2A6SMN1; SMN2LMNAL3MBTL1 | |
| Hydrochloric Acid SCHEMBL27645555 | 0.82 | SMN1; SMN2 (0.46) | TBXAS1SMN1; SMN2LMNAL3MBTL1ITGB3 | |
| SCHEMBL28924924 | 0.80 | SMN1; SMN2 (0.50) | TBXAS1CYP2A6SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL30065165 | 0.80 | SMN1; SMN2 (0.50) | TBXAS1CYP2A6SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL28924921 | 0.80 | SMN1; SMN2 (0.50) | TBXAS1CYP2A6SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL24919476 | 0.80 | SMN1; SMN2 (0.50) | TBXAS1CYP2A6SMN1; SMN2LMNAL3MBTL1 | |
| SCHEMBL30634135 | 0.79 | TBXAS1 (0.45) | TBXAS1SMN1; SMN2LMNAL3MBTL1GRM8 | |
| SCHEMBL8461393 | 0.77 | TBXAS1 (0.49) | TBXAS1SMN1; SMN2LMNAL3MBTL1GRM8 | |
| SCHEMBL28085892 | 0.77 | TBXAS1 (0.49) | TBXAS1SMN1; SMN2LMNAL3MBTL1GRM8 | |
| SCHEMBL28803513 | 0.77 | SMN1; SMN2 (0.47) | TBXAS1SMN1; SMN2LMNAL3MBTL1GRM8 |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116622792-B | Method for synthesizing (S) -nicotine by using enzyme catalysis | 修实生物医药(南通)有限公司 | 2024-03-08 | — | — | CN | claimed |
| CN-116622792-A | Method for synthesizing (S) -nicotine by using enzyme catalysis | 修实生物医药(南通)有限公司 | 2023-08-22 | — | — | CN | claimed |
| WO-2022228535-A1 | PREPARATION METHOD FOR NICOTINE AND INTERMEDIATE THEREOF | 武汉中有药业有限公司 | 2022-11-03 | — | — | WO | claimed |
| CN-115260088-A | Process for the preparation of nicotine and intermediates therefor | 武汉中有药业有限公司 | 2022-11-01 | — | — | CN | claimed |
| CN-116622792-B | Method for synthesizing (S) -nicotine by using enzyme catalysis | 修实生物医药(南通)有限公司 | 2024-03-08 | — | — | CN | disclosed |
| CN-116622792-A | Method for synthesizing (S) -nicotine by using enzyme catalysis | 修实生物医药(南通)有限公司 | 2023-08-22 | — | — | CN | disclosed |
| WO-2022228535-A1 | PREPARATION METHOD FOR NICOTINE AND INTERMEDIATE THEREOF | 武汉中有药业有限公司 | 2022-11-03 | — | — | WO | disclosed |
| CN-115260088-A | Process for the preparation of nicotine and intermediates therefor | 武汉中有药业有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-115260088-A | Process for the preparation of nicotine and intermediates therefor | 武汉中有药业有限公司 | 2022-11-01 | — | — | CN | disclosed |