Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.43 |
| ▸ | MME | P08473 | 2/20 | 0.41 |
| ▸ | CTSK | P43235 | 2/20 | 0.41 |
| ▸ | CTSS | P25774 | 1/20 | 0.41 |
| ▸ | ACE | P12821 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA7 | P43166 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.37 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.36 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.36 |
| ▸ | ADRB3 | P13945 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL15311168 | 0.86 | CTSK (0.49) | TRPA1CTSKCTSSSCN9ACA12 | |
| SCHEMBL14716956 | 0.86 | CTSK (0.49) | TRPA1CTSKCTSSSCN9ACA12 | |
| SCHEMBL27794800 | 0.86 | CTSK (0.49) | TRPA1CTSKCTSSSCN9ACA12 | |
| SCHEMBL27503389 | 0.83 | RAB9A (0.47) | CTSKSCN9ASMN1; SMN2HPGDLMNA | |
| SCHEMBL28564132 | 0.80 | OPRD1 (0.43) | — | |
| SCHEMBL29096455 | 0.80 | CTSS (0.40) | TRPA1MMECTSKCTSSACE | |
| SCHEMBL27574638 | 0.78 | FOLH1 (0.40) | MMECTSKCTSSACEKDM4E | |
| SCHEMBL27584343 | 0.77 | CTSB (0.46) | CTSKCTSSSCN9ALMNACTSL | |
| SCHEMBL27674503 | 0.77 | LMNA (0.39) | KDM4ESCN9AMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL27674502 | 0.77 | LMNA (0.39) | KDM4ESCN9AMEN1KMT2ASMN1; SMN2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116693447-A | Ketone amide derivative and pharmaceutical application thereof | 成都威斯克生物医药有限公司 | 2023-09-05 | — | — | CN | disclosed |