Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 4/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.48 |
| ▸ | USP2 | O75604 | 3/20 | 0.48 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | HPGD | P15428 | 1/20 | 0.48 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | PTAFR | P25105 | 3/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | KCNA5 | P22460 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.41 |
| ▸ | PIP4K2B | P78356 | 1/20 | 0.41 |
| ▸ | FYN | P06241 | 1/20 | 0.41 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7966515 | 1.00 | CYP1A2 (0.48) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL8118372 | 0.86 | CYP1A2 (0.51) | CYP1A2CYP3A4CYP2D6CYP2C19USP2 | |
| SCHEMBL7966264 | 0.86 | PTAFR (0.44) | PTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL7980165 | 0.85 | PTAFR (0.46) | HPGDPTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL7980167 | 0.85 | PTAFR (0.46) | HPGDPTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL8009648 | 0.84 | PTAFR (0.44) | HPGDPTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL7978613 | 0.84 | PTAFR (0.44) | HPGDPTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL7980003 | 0.84 | PTAFR (0.44) | HPGDPTAFRNAMPTCYP11B1CYP11B2 | |
| SCHEMBL7966525 | 0.84 | PTAFR (0.44) | CYP3A4MAPTPTAFRNAMPTCYP11B1 | |
| SCHEMBL7966529 | 0.84 | PTAFR (0.44) | CYP3A4MAPTPTAFRNAMPTCYP11B1 |
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-6300352-B1 | FOR THERAPY OF ASTHMA | ASTRAZENECA AB (SE) | 2001-10-09 | — | — | US | claimed |
| EP-0971892-A1 | NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | Astra Pharmaceuticals Limited (GB) | 2000-01-19 | — | — | EP | claimed |
| WO-1998042670-A1 | NOVEL PYRIDINE DERIVATIVES AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | ASTRA PHARMACEUTICALS LTD. (GB) | 1998-10-01 | — | — | WO | claimed |
| US-6300352-B1 | FOR THERAPY OF ASTHMA | ASTRAZENECA AB (SE) | 2001-10-09 | — | — | US | disclosed |