Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | PRCP | P42785 | 1/20 | 0.52 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | ENPP2 | Q13822 | 3/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.49 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.48 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 6/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.46 |
| ▸ | PRKACA | P17612 | 3/20 | 0.46 |
| ▸ | GSK3A | P49840 | 3/20 | 0.46 |
| ▸ | GSK3B | P49841 | 3/20 | 0.46 |
| ▸ | PRKX | P51817 | 2/20 | 0.46 |
| ▸ | PRKCQ | Q04759 | 2/20 | 0.46 |
| ▸ | MST1R | Q04912 | 1/20 | 0.46 |
| ▸ | ROCK2 | O75116 | 4/20 | 0.46 |
| ▸ | PRKG1 | Q13976 | 3/20 | 0.46 |
| ▸ | PRKCG | P05129 | 2/20 | 0.46 |
| ▸ | RPS6KB1 | P23443 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL5888533 | 1.00 | KMT2A (0.56) | KMT2AALDH1A1PRCPMAPTENPP2 | |
| SCHEMBL5888153 | 0.89 | PRCP (0.54) | KMT2AALDH1A1PRCPENPP2CYP3A4 | |
| SCHEMBL5888147 | 0.89 | PRCP (0.54) | KMT2AALDH1A1PRCPENPP2CYP3A4 | |
| SCHEMBL5218642 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1PRCP | |
| SCHEMBL5888633 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1PRCP | |
| SCHEMBL30795674 | 0.82 | ALDH1A1 (0.54) | KMT2AALDH1A1PRCP | |
| SCHEMBL5888420 | 0.82 | ALDH1A1 (0.50) | KMT2AALDH1A1PRCP | |
| SCHEMBL5888499 | 0.76 | CTSL (0.49) | KMT2AALDH1A1PRCPROCK1PRKACA | |
| SCHEMBL5215121 | 0.76 | CTSL (0.49) | KMT2AALDH1A1ROCK2 | |
| SCHEMBL5888341 | 0.76 | CTSL (0.49) | KMT2AALDH1A1ROCK2 |
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-7135472-B2 | 3-Heterocyclic benzylamide derivatives as potassium channel openers | BRISTOL-MYERS SQUIBB COMPANY (US) | 2006-11-14 | — | — | US | disclosed |