Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 6/20 | 0.55 |
| ▸ | TSHR | P16473 | 5/20 | 0.55 |
| ▸ | CA2 | P00918 | 4/20 | 0.55 |
| ▸ | GABRB2 | P47870 | 4/20 | 0.55 |
| ▸ | LMNA | P02545 | 3/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.55 |
| ▸ | CA1 | P00915 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 2/20 | 0.55 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.55 |
| ▸ | GABRG2 | P18507 | 2/20 | 0.55 |
| ▸ | GABRB3 | P28472 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.55 |
| ▸ | FAAH | O00519 | 1/20 | 0.55 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.55 |
| ▸ | HTR2C | P28335 | 1/20 | 0.55 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.55 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.55 |
| ▸ | HTR2B | P41595 | 1/20 | 0.55 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL5589720 | 0.87 | ALDH1A1 (0.52) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL9721055 | 0.78 | GABRA1 (0.64) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL8644420 | 0.75 | GPR35 (0.64) | TSHRLMNACYP3A4HPGDCYP1A2 | |
| SCHEMBL565882 | 0.74 | GABRA1 (0.56) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL3785333 | 0.74 | TSHR (0.50) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL5589726 | 0.73 | CYP2D6 (0.34) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL7306128 | 0.73 | TSHR (0.36) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL6820234 | 0.73 | CYP1A2 (0.45) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL9720918 | 0.72 | GABRA1 (0.50) | GABRA1TSHRCA2GABRB2LMNA | |
| SCHEMBL7304304 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5629406-A | AMINO ACID DERIVATIVES | SANKYO COMPANY, LIMITED (JP) | 1997-05-13 | — | — | US | disclosed |
| EP-0587311-A1 | Peptides capable of inhibiting the activity of HIV protease, their preparation and their therapeutic use | SANKYO COMPANY LIMITED (JP) | 1994-03-16 | — | — | EP | disclosed |
| EP-0025659-B1 | PROCESSES FOR THE PRODUCTION OF 1,2,3-TRIHYDROXYPHENYL COMPOUNDS | FBC LIMITED (GB) | 1983-11-02 | — | — | EP | disclosed |
| US-4351968-A | Production of organic compounds | FBC LIMITED (GB) | 1982-09-28 | — | — | US | disclosed |
| EP-0025659-A2 | Processes for the production of 1,2,3-trihydroxyphenyl compounds | FBC LIMITED (GB) | 1981-03-25 | — | — | EP | disclosed |