Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 3/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 3/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 3/20 | 0.36 |
| ▸ | CHRM3 | P20309 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.34 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL28044647 | 0.83 | CYP2C9 (0.52) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| SCHEMBL9447535 | 0.75 | CYP2C9 (0.50) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| SCHEMBL5709851 | 0.74 | BID (0.47) | — | |
| SCHEMBL11567881 | 0.74 | CYP2C9 (0.40) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| SCHEMBL8134336 | 0.72 | SMN1; SMN2 (0.44) | CYP2C9LMNACYP2D6HIF1ACHRM2 | |
| Benzylic Acid SCHEMBL21434289 | 0.72 | CYP2C9 (0.68) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| Benzylic Acid SCHEMBL7066 | 0.72 | CYP2C9 (0.74) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| Benzylic Acid SCHEMBL4823051 | 0.70 | CYP2C9 (0.65) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| Benzylic Acid SCHEMBL9181980 | 0.70 | CYP2C9 (0.71) | CYP2C9LMNAHTTL3MBTL1CYP2D6 | |
| Benzylic Acid SCHEMBL20957595 | 0.70 | CYP2C9 (0.71) | CYP2C9LMNAHTTL3MBTL1CYP2D6 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5780051-A | Methods and articles of manufacture for nicotine cessation and monitoring nicotine use | DYNAGEN, INC. (US) | 1998-07-14 | — | — | US | disclosed |
| US-5707872-A | CYANOGEN RELEASING AGENT AND CYANOGEN HALIDE FORMING AGENT FOR TREATMENT OF URINE | DYNAGEN, INC. (US) | 1998-01-13 | — | — | US | disclosed |
| EP-0634013-A1 | A NICOTINE AND/OR NICOTINE METABOLITE DETECTION SYSTEM. | DYNAGEN INC (US) | 1995-01-18 | — | — | EP | disclosed |
| WO-1993020438-A1 | A NICOTINE AND/OR NICOTINE METABOLITE DETECTION SYSTEM | DYNAGEN, INC. (US) | 1993-10-14 | — | — | WO | disclosed |