Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR52 | Q9Y2T5 | 2/20 | 0.74 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.57 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.53 |
| ▸ | ALOX5 | P09917 | 2/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.50 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | TOP1 | P11387 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.47 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.47 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.46 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL7426203 | 1.00 | GPR52 (0.74) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL6373065 | 0.85 | GPR52 (1.00) | GPR52TRPV1KEAP1ALOX5 | |
| SCHEMBL6373067 | 0.85 | GPR52 (1.00) | GPR52TRPV1KEAP1ALOX5 | |
| SCHEMBL11974561 | 0.84 | MAOB (0.58) | GPR52TRPV1ALDH1A1MAOBMAPT | |
| SCHEMBL3341890 | 0.84 | GPR52 (0.72) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL3341887 | 0.84 | GPR52 (0.72) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL13879584 | 0.81 | GPR52 (0.68) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL17061484 | 0.81 | GPR52 (0.68) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL17061485 | 0.81 | GPR52 (0.78) | GPR52TRPV1KEAP1ALOX5ALDH1A1 | |
| SCHEMBL13000214 | 0.80 | MAPT (0.57) | GPR52TRPV1MAPTHTTHDAC2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0732923-A1 | PHARMACEUTICAL COMPOSITIONS CONTAINING HIV PROTEASE INHIBITORS | Abbott Laboratories (US) | 1996-09-25 | — | — | EP | disclosed |
| WO-1995020384-A1 | PHARMACEUTICAL COMPOSITIONS CONTAINING HIV PROTEASE INHIBITORS | ABBOTT LABORATORIES (US) | 1995-08-03 | — | — | WO | disclosed |