Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 1/20 | 0.60 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.53 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.53 |
| ▸ | HSD17B1 | P14061 | 3/20 | 0.50 |
| ▸ | ESR1 | P03372 | 4/20 | 0.47 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.47 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.46 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | AR | P10275 | 1/20 | 0.42 |
| ▸ | ANPEP | P15144 | 1/20 | 0.42 |
| ▸ | DPP4 | P27487 | 1/20 | 0.42 |
| ▸ | APP | P05067 | 1/20 | 0.41 |
| ▸ | BACE1 | P56817 | 1/20 | 0.41 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.39 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.39 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.39 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.38 |
| ▸ | DAO | P14920 | 1/20 | 0.37 |
| ▸ | DDO | Q99489 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL3558975 | 0.86 | HSD17B1 (0.53) | AKR1B1PTPN5GABRA1GABRB2HSD17B1 | |
| SCHEMBL9198775 | 0.83 | ALOX5 (0.60) | AKR1B1PTPN5GABRA1GABRB2ESR1 | |
| SCHEMBL10454627 | 0.80 | GABRA1 (0.59) | AKR1B1PTPN5GABRA1GABRB2HSD17B1 | |
| SCHEMBL16581416 | 0.80 | HSD17B1 (0.62) | GABRA1GABRB2HSD17B1ESR1ESR2 | |
| SCHEMBL3953461 | 0.79 | HSD17B1 (0.71) | GABRA1GABRB2HSD17B1ESR1ESR2 | |
| SCHEMBL16527783 | 0.79 | GABRA1 (0.76) | PTPN5GABRA1GABRB2ANPEPDPP4 | |
| SCHEMBL10911038 | 0.78 | GABRA1 (0.61) | PTPN5GABRA1GABRB2ANPEPDPP4 | |
| SCHEMBL13678958 | 0.77 | HSD17B1 (0.75) | GABRA1GABRB2HSD17B1ESR1ESR2 | |
| SCHEMBL4907630 | 0.76 | AKR1B1 (1.00) | AKR1B1GABRA1GABRB2ALOX5 | |
| SCHEMBL2030094 | 0.76 | TLR8 (0.49) | AKR1B1PTPN5GABRA1GABRB2HSD17B1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0382213-B1 | Biphenyl derivative, nerve cell degeneration repairing or protecting agent and process for preparing a phenyl derivative contained in the agent | OTSUKA PHARMA CO LTD (JP) | 1995-05-10 | — | — | EP | disclosed |
| US-5053548-A | Containing hydroxy substituents; nervous system disorders | OTSUKA PHARMACEUTICAL COMPANY, LTD. (JP) | 1991-10-01 | — | — | US | disclosed |
| EP-0382213-A2 | Biphenyl derivative, nerve cell degeneration repairing or protecting agent and process for preparing a phenyl derivative contained in the agent | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1990-08-16 | — | — | EP | disclosed |