Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNMT | P11086 | 6/20 | 0.54 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.54 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.45 |
| ▸ | CA12 | O43570 | 1/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | CA7 | P43166 | 1/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.43 |
| ▸ | TDP2 | O95551 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.37 |
| ▸ | STS | P08842 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 2/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL4525476 | 1.00 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL1706815 | 0.95 | PNMT (0.54) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL13193777 | 0.92 | PNMT (0.52) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL18454733 | 0.89 | — | — | |
| SCHEMBL31122821 | 0.89 | PNMT (0.58) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL20978055 | 0.78 | ADRA2A (0.57) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL8041840 | 0.78 | PNMT (0.77) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL15424369 | 0.78 | PNMT (0.48) | PNMTADRA2AADRA2BADRA2CALDH1A1 | |
| SCHEMBL8055291 | 0.77 | DRD1 (0.50) | PNMTADRA2AADRA2BADRA2C | |
| SCHEMBL2988432 | 0.77 | PNMT (0.67) | PNMTADRA2AADRA2BADRA2C |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022121805-A1 | FUSED RING COMPOUND AS NAV1.8 INHIBITOR AND USE THEREOF | 成都康弘药业集团股份有限公司 | 2022-06-16 | — | — | WO | disclosed |
| CN-114591293-A | Fused ring compound as Nav1.8 inhibitor and application thereof | 成都康弘药业集团股份有限公司 | 2022-06-07 | — | — | CN | disclosed |