Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | PTGES2 | Q9H7Z7 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.43 |
| ▸ | NFKBIA | P25963 | 2/20 | 0.43 |
| ▸ | RELA | Q04206 | 2/20 | 0.43 |
| ▸ | PGAM1 | P18669 | 1/20 | 0.42 |
| ▸ | MCOLN3 | Q8TDD5 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | BLM | P54132 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HSPD1 | P10809 | 1/20 | 0.41 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.41 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.41 |
| ▸ | HSPE1 | P61604 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7590087 | 0.85 | GSK3B (0.44) | ALDH1A1MEN1KMT2AHSPD1PTPN2 | |
| SCHEMBL7572091 | 0.85 | CCR2 (0.54) | ALDH1A1PTGES2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7593138 | 0.83 | PTGES2 (0.56) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA | |
| SCHEMBL7567353 | 0.81 | PTGES2 (0.50) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA | |
| SCHEMBL7588412 | 0.79 | SMN1; SMN2 (0.52) | ALDH1A1PTGES2SMN1; SMN2MEN1KMT2A | |
| SCHEMBL7567408 | 0.79 | ACLY (0.50) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA | |
| SCHEMBL7578661 | 0.78 | CCR2 (0.56) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA | |
| SCHEMBL7595317 | 0.76 | ACLY (0.40) | MEN1KMT2AHSPD1PTPN2PTPN1 | |
| SCHEMBL7601861 | 0.76 | SMN1; SMN2 (0.47) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA | |
| SCHEMBL7573886 | 0.75 | THRB (0.56) | ALDH1A1PTGES2SMN1; SMN2NFKBIARELA |
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-2002083629-A1 | BISSULFONAMIDE DERIVATIVES AS INHIBITORS OF DEHYDROQUINATE SYNTHETASES AND TYPE II DEHYDROQUINASES | ARROW THERAPEUTICS LIMITED (GB) | 2002-10-24 | — | — | WO | disclosed |