Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPRT1 | P00492 | 1/20 | 0.50 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.47 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | APEX1 | P27695 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.43 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | PAK1 | Q13153 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL17841964 | 0.85 | HPRT1 (0.58) | HPRT1CYP2A6CYP1A2MAPTLMNA | |
| SCHEMBL11076291 | 0.85 | HPRT1 (0.58) | HPRT1CYP2A6PTPN22CYP1A2POLB | |
| SCHEMBL28105537 | 0.83 | HPRT1 (0.47) | HPRT1CYP2A6PTPN22CYP1A2POLB | |
| SCHEMBL27869292 | 0.79 | HPRT1 (0.50) | HPRT1CYP2A6PTPN22CYP1A2POLB | |
| SCHEMBL27769273 | 0.79 | HPRT1 (0.52) | HPRT1CYP2A6PTPN22CYP1A2POLB | |
| SCHEMBL27278968 | 0.77 | CYP1A2 (0.48) | HPRT1CYP2A6CYP1A2MAPTLMNA | |
| SCHEMBL11779519 | 0.77 | HPRT1 (0.58) | HPRT1CYP2A6PTPN22CYP1A2MAPT | |
| SCHEMBL17841962 | 0.77 | CYP1A2 (0.60) | HPRT1CYP2A6CYP1A2MAPTLMNA | |
| SCHEMBL30849902 | 0.77 | CYP1A2 (0.67) | HPRT1PTPN22CYP1A2POLBMAPT | |
| SCHEMBL2849271 | 0.77 | CYP1A2 (0.60) | HPRT1CYP2A6CYP1A2MAPTLMNA |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1120155-C | 2,6-dichloro-4-pyridinemethanol derivatives and agricultural chemicals | DAINIPPON INK & CHEMICALS (JP) | 2003-09-03 | — | — | CN | claimed |
| CN-1270581-A | 2,6-dichloro-4-pyridinemethanol derivatives and agricultural chemicals | DAINIPPON INK & CHEMICALS (US) | 2000-10-18 | — | — | CN | claimed |
| CN-104837818-A | Pyridine-2-amides useful as CB2 agonists | HOFFMANN LA ROCHE | 2015-08-12 | — | — | CN | disclosed |
| CN-1120155-C | 2,6-dichloro-4-pyridinemethanol derivatives and agricultural chemicals | DAINIPPON INK & CHEMICALS (JP) | 2003-09-03 | — | — | CN | disclosed |
| CN-1270581-A | 2,6-dichloro-4-pyridinemethanol derivatives and agricultural chemicals | DAINIPPON INK & CHEMICALS (US) | 2000-10-18 | — | — | CN | disclosed |