Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.69 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.69 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.68 |
| ▸ | HSD17B3 | P37058 | 6/20 | 0.67 |
| ▸ | STS | P08842 | 4/20 | 0.66 |
| ▸ | MAPT | P10636 | 1/20 | 0.60 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 2/20 | 0.57 |
| ▸ | RAB9A | P51151 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| SCHEMBL9045542 | 1.00 | HDAC8 (0.69) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL27387801 | 1.00 | HDAC8 (0.69) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL12016810 | 1.00 | HDAC8 (0.69) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL10865339 | 1.00 | HDAC8 (0.69) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL9522917 | 1.00 | HDAC8 (0.69) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL1304627 | 0.98 | PDE4B (0.70) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL22034392 | 0.95 | HDAC8 (0.64) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL4530719 | 0.93 | PDE4B (0.72) | HDAC8HDAC1PDE4BHSD17B3STS | |
| SCHEMBL3171960 | 0.91 | PDE4B (0.79) | HDAC8HDAC1PDE4BMAPTL3MBTL1 | |
| SCHEMBL8984256 | 0.91 | HDAC8 (0.58) | HDAC8HDAC1PDE4BHSD17B3STS |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113354586-B | Preparation method of trifluoromethyl-containing pyrazolone compound | 大连理工大学 | 2022-06-10 | — | — | CN | disclosed |
| CN-113717092-A | Preparation method of trifluoromethyl-containing 3-substituted-2-indolinone compound | 美罗药业股份有限公司 | 2021-11-30 | — | — | CN | disclosed |
| CN-113354586-A | Preparation method of trifluoromethyl-containing pyrazolone compound | 大连理工大学 | 2021-09-07 | — | — | CN | disclosed |
| EP-2349255-B1 | 2-ACYLAMINOPROPOANOL-TYPE GLUCOSYLCERAMIDE SYNTHASE INHIBITORS | GENZYME CORP (US) | 2016-03-30 | — | — | EP | disclosed |
| EP-0299379-B1 | PENTADIENAMIDE PAF-ANTAGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 1993-04-21 | — | — | EP | disclosed |
| US-4975438-A | ANTICOAGULANT | HOFFMANN-LA ROCHE INC. (US) | 1990-12-04 | — | — | US | disclosed |
| US-4788206-A | CARDIOVASCULAR DISORDERS, PLATELETS | HOFFMANN-LA ROCHE INC. (US) | 1988-11-29 | — | — | US | disclosed |