Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | LAP3 | P28838 | 4/20 | 0.46 |
| ▸ | ANPEP | P15144 | 2/20 | 0.46 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.46 |
| ▸ | ACP3 | P15309 | 1/20 | 0.45 |
| ▸ | ALPI | P09923 | 1/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.44 |
| ▸ | XIAP | P98170 | 1/20 | 0.44 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.43 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.42 |
| ▸ | CPA1 | P15085 | 1/20 | 0.42 |
| ▸ | CPA3 | P15088 | 1/20 | 0.42 |
| ▸ | FOLH1 | Q04609 | 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 | |
|---|---|---|---|---|
| SCHEMBL7361412 | 1.00 | CYP1A2 (0.47) | CYP1A2ALDH1A1MAPTLAP3ANPEP | |
| SCHEMBL7411122 | 0.91 | ALDH1A1 (0.52) | ALDH1A1MAPTANPEPADAMTS5ACP3 | |
| SCHEMBL14637889 | 0.83 | CYP1A2 (0.50) | CYP1A2LAP3ANPEPACP3ALPI | |
| SCHEMBL14637890 | 0.83 | CYP1A2 (0.50) | CYP1A2LAP3ANPEPACP3ALPI | |
| SCHEMBL9137759 | 0.81 | AKR1B1 (0.42) | ADAMTS5 | |
| SCHEMBL7417513 | 0.81 | PPARG (0.55) | — | |
| SCHEMBL9715663 | 0.81 | CYP1A2 (0.44) | CYP1A2ALDH1A1MAPTLAP3ANPEP | |
| SCHEMBL9715664 | 0.81 | CYP1A2 (0.44) | CYP1A2ALDH1A1MAPTLAP3ANPEP | |
| SCHEMBL121728 | 0.80 | MAPT (0.61) | CYP1A2ALDH1A1MAPTADAMTS5ALPI | |
| SCHEMBL121727 | 0.80 | MAPT (0.61) | CYP1A2ALDH1A1MAPTADAMTS5ALPI |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103930437-A | Potent and selective inhibitors of Nav1.3 and Nav1.7 | AMGEN INC | 2014-07-16 | — | — | CN | disclosed |
| EP-0846127-A1 | ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY | Novartis AG (CH) | 1998-06-10 | — | — | EP | disclosed |
| WO-1997008193-A1 | ACYLATED OLIGOPEPTIDE DERIVATIVES HAVING CELL SIGNAL INHIBITING ACTIVITY | NOVARTIS AG (CH) | 1997-03-06 | — | — | WO | disclosed |