Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | CA1 | P00915 | 3/20 | 0.47 |
| ▸ | CA2 | P00918 | 3/20 | 0.47 |
| ▸ | CA12 | O43570 | 2/20 | 0.47 |
| ▸ | CA7 | P43166 | 2/20 | 0.47 |
| ▸ | CA9 | Q16790 | 2/20 | 0.47 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 2/20 | 0.43 |
| ▸ | HSD17B2 | P37059 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | STS | P08842 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL19682940 | 1.00 | ALDH1A1 (0.49) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL22636952 | 0.85 | ALDH1A1 (0.46) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL3471632 | 0.80 | ALDH1A1 (0.67) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL2474590 | 0.80 | CA12 (0.51) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL13193177 | 0.80 | CA12 (0.54) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL28289517 | 0.80 | CA12 (0.54) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL6990343 | 0.79 | CA12 (0.53) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL7621544 | 0.78 | HSD17B2 (0.58) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL10614568 | 0.77 | CA12 (0.51) | ALDH1A1CA1CA2CA12CA7 | |
| SCHEMBL4180274 | 0.77 | LMNA (0.54) | ALDH1A1CA1CA2CA12CA7 |
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-109563057-B | Sulfonamide compound or salt thereof | 大鹏药品工业株式会社 | 2022-06-24 | — | — | CN | disclosed |