Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SCN9A | Q15858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.37 |
| ▸ | CTSK | P43235 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 6/20 | 0.37 |
| ▸ | CA1 | P00915 | 6/20 | 0.37 |
| ▸ | CA2 | P00918 | 5/20 | 0.37 |
| ▸ | CA9 | Q16790 | 5/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 2/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.35 |
| ▸ | CA7 | P43166 | 1/20 | 0.35 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | GAA | P10253 | 1/20 | 0.34 |
| ▸ | RAB9A | P51151 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19983074 | 0.79 | KMT2A (0.40) | SCN9ACTSSCTSKCA12CA1 | |
| SCHEMBL32665252 | 0.77 | CHRNB2 (0.48) | CA12CA1CA2CA9 | |
| SCHEMBL19983027 | 0.76 | LMNA (0.41) | SCN9ACTSSCTSKKMT2ARAB9A | |
| SCHEMBL32665418 | 0.74 | CA12 (0.50) | CTSSCTSKCA12CA1CA2 | |
| SCHEMBL18921519 | 0.74 | CTSS (0.39) | SCN9ACTSSCTSKCA12CA1 | |
| SCHEMBL21601400 | 0.74 | SCN9A (0.51) | SCN9ACA12CA1CA2CA9 | |
| SCHEMBL12671642 | 0.73 | KCNA5 (0.41) | SCN9ACTSSCTSKCA12CA1 | |
| SCHEMBL1549969 | 0.72 | ALDH1A1 (0.46) | SCN9ACTSSCTSKCA12CA1 | |
| SCHEMBL32665511 | 0.72 | CA12 (0.51) | CA12CA1CA2CA9KMT2A | |
| SCHEMBL32665495 | 0.72 | NPC1 (0.51) | KMT2ARAB9A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018053353-A1 | KETONE INHIBITORS OF LYSINE GINGIPAIN | Cortexyme, Inc. (US) | 2018-03-22 | — | — | WO | disclosed |