Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 4/20 | 0.67 |
| ▸ | RAB9A | P51151 | 4/20 | 0.67 |
| ▸ | ATM | Q13315 | 1/20 | 0.67 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.62 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.62 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.62 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.62 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.62 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.62 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.62 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.62 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.62 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.62 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.62 |
| ▸ | SRC | P12931 | 2/20 | 0.54 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.54 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.52 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL18356776 | 0.95 | NPC1 (0.64) | NPC1RAB9AATMHDAC8HDAC6 | |
| SCHEMBL9991081 | 0.86 | HDAC8 (0.60) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| SCHEMBL5051923 | 0.85 | HDAC3 (0.64) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| SCHEMBL28231668 | 0.85 | TLR8 (0.53) | NPC1RAB9AATMHDAC8HDAC6 | |
| SCHEMBL16271201 | 0.84 | HDAC8 (0.61) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| SCHEMBL4224259 | 0.84 | HDAC8 (0.61) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| Bromide SCHEMBL1888885 | 0.84 | L3MBTL1 (0.59) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| SCHEMBL2189376 | 0.84 | HDAC8 (0.61) | NPC1RAB9AHDAC8HDAC6HDAC3 | |
| SCHEMBL18373097 | 0.84 | HDAC8 (0.59) | NPC1RAB9AATMHDAC8HDAC6 | |
| SCHEMBL4216458 | 0.84 | HDAC3 (0.66) | NPC1RAB9AHDAC8HDAC6HDAC3 |
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-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | claimed |
| EP-1921072-A1 | 1,2,3-Triazole derivatives as cannabinoid-receptor modulators | Laboratorios del Dr. Esteve S.A. (ES) | 2008-05-14 | — | — | EP | disclosed |