Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.41 |
| ▸ | MMP9 | P14780 | 1/20 | 0.41 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | HRH4 | Q9H3N8 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.40 |
| ▸ | MME | P08473 | 2/20 | 0.40 |
| ▸ | ACE | P12821 | 2/20 | 0.40 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.40 |
| ▸ | CDYL | Q9Y232 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 7/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL10477711 | 0.89 | MMP9 (0.42) | MMP9CTNNB1L3MBTL1HRH4KDM4E | |
| SCHEMBL10477863 | 0.85 | CTNNB1 (0.45) | CYP1A2CYP2C19MMP9CTNNB1HRH4 | |
| SCHEMBL10477661 | 0.84 | CTNNB1 (0.50) | CYP1A2CYP2C19MMP9CTNNB1L3MBTL1 | |
| SCHEMBL10756689 | 0.81 | CTNNB1 (0.50) | CYP1A2CYP2C19MMP9CTNNB1HRH4 | |
| SCHEMBL10477683 | 0.81 | MMP9 (0.40) | MMP9CTNNB1L3MBTL1HRH4KDM4E | |
| SCHEMBL7310334 | 0.81 | NPC1 (0.48) | CYP1A2CYP2C19MMP9CTNNB1HRH4 | |
| SCHEMBL7272298 | 0.81 | NPC1 (0.48) | CYP1A2CYP2C19MMP9CTNNB1HRH4 | |
| SCHEMBL10477689 | 0.80 | KDM4E (0.44) | MMP9CTNNB1L3MBTL1HRH4KDM4E | |
| SCHEMBL7290086 | 0.77 | TSHR (0.48) | MMP9CTNNB1HRH4KDM4EKMT2A | |
| SCHEMBL8482142 | 0.77 | MMP9 (0.50) | CYP1A2CYP2C19MMP9CTNNB1HRH4 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4857650-A | Novel renin inhibitory amino acid derivatives | KISSEI PHARMACEUTICAL CO., LTD. (JP) | 1989-08-15 | — | — | US | disclosed |
| EP-0206807-A2 | Novel amino acid derivatives | Kissei Pharmaceutical Co. Ltd. (JP) | 1986-12-30 | — | — | EP | disclosed |