Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | CTSB | P07858 | 2/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.47 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.46 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.46 |
| ▸ | CPA1 | P15085 | 2/20 | 0.45 |
| ▸ | CPA3 | P15088 | 2/20 | 0.45 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.45 |
| ▸ | CPB1 | P15086 | 1/20 | 0.45 |
| ▸ | CPB2 | Q96IY4 | 1/20 | 0.45 |
| ▸ | SLC15A1 | P46059 | 1/20 | 0.45 |
| ▸ | LTA4H | P09960 | 1/20 | 0.45 |
| ▸ | LAP3 | P28838 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL7301662 | 1.00 | CYP1A2 (0.50) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL7292873 | 1.00 | CYP1A2 (0.50) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL24535009 | 0.92 | ALDH1A1 (0.52) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL7319425 | 0.86 | CYP1A2 (0.49) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL7319419 | 0.86 | CYP1A2 (0.49) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL563663 | 0.86 | PPARG (0.53) | CYP1A2ALDH1A1L3MBTL1KMT2ACPA1 | |
| SCHEMBL24535020 | 0.86 | ALDH1A1 (0.50) | CYP1A2CTSBALDH1A1HCAR2MAPK1 | |
| SCHEMBL490152 | 0.85 | CYP1A2 (0.52) | CYP1A2ALDH1A1KMT2ACPA1CYP2C9 | |
| SCHEMBL490150 | 0.85 | CYP1A2 (0.52) | CYP1A2ALDH1A1KMT2ACPA1CYP2C9 | |
| SCHEMBL21811160 | 0.84 | CYP1A2 (0.59) | CYP1A2ALDH1A1HCAR2MAPK1L3MBTL1 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0439556-A4 | HETEROCYCLIC PEPTIDE RENIN INHIBITORS | — | 1991-10-30 | — | — | EP | disclosed |