Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 6/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 5/20 | 0.52 |
| ▸ | TSHR | P16473 | 5/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | CPB1 | P15086 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 6/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | ANPEP | P15144 | 3/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.42 |
| ▸ | LAP3 | P28838 | 2/20 | 0.41 |
| ▸ | RNPEP | Q9H4A4 | 1/20 | 0.41 |
| ▸ | DNPEP | Q9ULA0 | 1/20 | 0.41 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SLC6A4 | P31645 | 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 | |
|---|---|---|---|---|
| SCHEMBL10590665 | 0.93 | CYP3A4 (0.47) | CYP1A2CYP3A4TSHRCYP2D6HSD17B10 | |
| SCHEMBL7361302 | 0.93 | CYP1A2 (0.47) | CYP1A2CYP3A4TSHRCYP2D6HSD17B10 | |
| SCHEMBL7357914 | 0.81 | ESR1 (0.39) | CYP1A2CYP3A4TSHRCYP2D6HSD17B10 | |
| SCHEMBL7360306 | 0.78 | SLC15A1 (0.47) | CYP1A2CYP3A4TSHRCYP2D6HSD17B10 | |
| SCHEMBL10591375 | 0.77 | SLC15A1 (0.43) | LTA4HANPEPLAP3RNPEPDNPEP | |
| SCHEMBL7368172 | 0.77 | TAAR1 (0.44) | LTA4HANPEPLAP3RNPEPDNPEP | |
| SCHEMBL7325758 | 0.72 | KLK5 (0.58) | KMT2A | |
| SCHEMBL10377216 | 0.72 | KLK5 (0.58) | KMT2A | |
| SCHEMBL11998024 | 0.71 | CSNK1E (0.39) | CYP2D6LTA4HANPEPLAP3RNPEP | |
| SCHEMBL8174333 | 0.70 | LTA4H (0.77) | HSD17B10CYP2C19CYP2C9ALDH1A1LTA4H |
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 |
|---|---|---|---|---|---|---|---|
| EP-0415981-A4 | RETROVIRAL PROTEASE INHIBITORS | — | 1991-10-09 | — | — | EP | disclosed |
| EP-0415981-A1 | RETROVIRAL PROTEASE INHIBITORS | ABBOTT LABORATORIES (US) | 1991-03-13 | — | — | EP | disclosed |
| EP-0342541-A2 | Retroviral protease inhibitors | ABBOTT LABORATORIES (US) | 1989-11-23 | — | — | EP | disclosed |
| WO-1989010752-A1 | RETROVIRAL PROTEASE INHIBITORS | ABBOTT LABORATORIES (US) | 1989-11-16 | — | — | WO | disclosed |