Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 3/20 | 0.33 |
| ▸ | FEN1 | P39748 | 3/20 | 0.33 |
| ▸ | BRD4 | O60885 | 1/20 | 0.33 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.33 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.33 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.33 |
| ▸ | PDK3 | Q15120 | 1/20 | 0.33 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA7 | P43166 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL9867057 | 0.81 | ALDH1A1 (0.35) | ALDH1A1GAALMNAKMT2AMEN1 | |
| SCHEMBL10374251 | 0.80 | ALDH1A1 (0.39) | ALDH1A1HPGDLMNAPOLBHTT | |
| SCHEMBL9867680 | 0.80 | NFE2L2 (0.34) | ALDH1A1CA12CA2CA9 | |
| SCHEMBL9866236 | 0.80 | POLB (0.48) | ALDH1A1GAAHPGDBRD4LMNA | |
| SCHEMBL9866318 | 0.79 | ALDH1A1 (0.36) | ALDH1A1GAALMNAHTTSMN1; SMN2 | |
| SCHEMBL9866944 | 0.78 | FEN1 (0.35) | ALOX5APFEN1 | |
| SCHEMBL9865825 | 0.77 | NFE2L2 (0.33) | CA12CA2CA9 | |
| SCHEMBL9867686 | 0.77 | NFE2L2 (0.33) | KMT2APOLBPKM | |
| SCHEMBL9867665 | 0.77 | KEAP1 (0.43) | ALDH1A1GAALMNAKMT2ACA12 | |
| SCHEMBL9866452 | 0.77 | ALDH1A1 (0.43) | ALDH1A1GAAHPGDALOX5APFEN1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4987141-A | DERIVATIVES OF BENZENE OR PYRIDINE HAVING SULFONATE AND SULFENYL, SULFONIMIDE OR SULFONAMIDE GROUPS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1991-01-22 | — | — | US | disclosed |