Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.60 |
| ▸ | TSHR | P16473 | 2/20 | 0.58 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 3/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | BRAF | P15056 | 2/20 | 0.55 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.53 |
| ▸ | NAMPT | P43490 | 1/20 | 0.52 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.52 |
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.51 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
| ▸ | CSF1R | P07333 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL20917054 | 1.00 | ALDH1A1 (0.60) | ALDH1A1TSHRMAPK1RAB9ANPC1 | |
| SCHEMBL30438569 | 0.90 | SLC6A4 (0.61) | ALDH1A1RAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL20917272 | 0.90 | SLC6A4 (0.61) | ALDH1A1RAB9ANPC1SMN1; SMN2MEN1 | |
| SCHEMBL20917067 | 0.85 | CACNA2D1 (0.59) | ALDH1A1TSHRMAPK1RAB9ANPC1 | |
| SCHEMBL30438361 | 0.85 | CACNA2D1 (0.59) | ALDH1A1TSHRMAPK1RAB9ANPC1 | |
| SCHEMBL30438447 | 0.82 | SLC6A2 (0.52) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL20917104 | 0.82 | SLC6A2 (0.52) | ALDH1A1TSHRRAB9ANPC1SMN1; SMN2 | |
| SCHEMBL20917059 | 0.82 | SLC6A4 (0.66) | ALDH1A1TSHRMAPK1RAB9ANPC1 | |
| SCHEMBL22714186 | 0.81 | SLC6A4 (0.51) | TSHRMAPK1RAB9ANPC1MEN1 | |
| SCHEMBL20917077 | 0.80 | KCNK3 (0.54) | TSHRRAB9ASMN1; SMN2MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| CN-111225901-B | Propylamine derivatives for the treatment of pain and pain-related disorders | 埃斯特韦制药股份公司 | 2023-07-04 | — | — | CN | claimed |
| CN-111225901-B | Propylamine derivatives for the treatment of pain and pain-related disorders | 埃斯特韦制药股份公司 | 2023-07-04 | — | — | CN | disclosed |