Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | CASP1 | P29466 | 1/20 | 0.30 |
| ▸ | CASP7 | P55210 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9058336 | 0.79 | HTT (0.36) | ALDH1A1 | |
| SCHEMBL9057057 | 0.76 | MAPT (0.36) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL8950506 | 0.72 | GAA (0.31) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL1559393 | 0.59 | ALDH1A1 (0.35) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL23159690 | 0.53 | ALDH1A1 (0.39) | KDM4EALDH1A1GAAMAPTHPGD | |
| SCHEMBL28780485 | 0.52 | INMT (0.44) | KDM4EALDH1A1MAPT | |
| SCHEMBL956319 | 0.51 | ALOX5 (0.41) | ALDH1A1GAAHPGD | |
| SCHEMBL4742 | 0.48 | — | — | |
| SCHEMBL14949950 | 0.47 | GBA1 (0.37) | KDM4EALDH1A1GAAMAPT | |
| SCHEMBL4394186 | 0.47 | — | — |
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-1996022099-A1 | OPHTHALMIC COMPOSITIONS FOR TREATING GLAUCOMA | ALCON LABORATORIES, INC. (US) | 1996-07-25 | — | — | WO | disclosed |
| WO-1995019981-A1 | THIENOTHIAZINE SULFONAMIDE DERIVATIVES PROCESS AND INTERMEDIATES FOR THEIR PREPARATION AND THEIR USE AS CARBONIC ANHYDRASE INHIBITORS | ALCON LABORATORIES, INC. (US) | 1995-07-27 | — | — | WO | disclosed |