Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.35 |
| ▸ | KDM1A | O60341 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 2/20 | 0.35 |
| ▸ | PTGER1 | P34995 | 2/20 | 0.35 |
| ▸ | MRGPRX4 | Q96LA9 | 2/20 | 0.34 |
| ▸ | MMP13 | P45452 | 1/20 | 0.34 |
| ▸ | RAF1 | P04049 | 2/20 | 0.34 |
| ▸ | BRAF | P15056 | 2/20 | 0.34 |
| ▸ | PPARG | P37231 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL26608480 | 1.00 | HDAC1 (0.38) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL26608475 | 0.81 | HDAC1 (0.41) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL31336252 | 0.81 | HDAC1 (0.41) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL26608377 | 0.78 | L3MBTL1 (0.41) | HDAC1HDAC8HDAC6HDAC5KDM1A | |
| SCHEMBL30593187 | 0.73 | HDAC1 (0.41) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL26608380 | 0.73 | HDAC1 (0.41) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL26608374 | 0.72 | CNR2 (0.36) | HDAC1HDAC8HDAC6HDAC5SYK | |
| SCHEMBL30593153 | 0.70 | ALDH1A1 (0.43) | HDAC1HDAC8HDAC6HDAC5MRGPRX4 | |
| SCHEMBL26608363 | 0.70 | ALDH1A1 (0.43) | HDAC1HDAC8HDAC6HDAC5MRGPRX4 | |
| SCHEMBL26608223 | 0.70 | ALDH1A1 (0.43) | HDAC1HDAC8HDAC6HDAC5MRGPRX4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119546580-A | Heteroaryl compounds for the treatment of pain | 沃泰克斯药物股份有限公司 | 2025-02-28 | — | — | CN | disclosed |
| EP-4511115-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | Vertex Pharmaceuticals Incorporated (US) | 2025-02-26 | — | — | EP | disclosed |
| WO-2023205468-A1 | HETEROARYL COMPOUNDS FOR THE TREATMENT OF PAIN | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2023-10-26 | — | — | WO | disclosed |