Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.56 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 1/20 | 0.54 |
| ▸ | PLA2G10 | O15496 | 1/20 | 0.46 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4673352 | 0.85 | MAPK1 (0.50) | ROCK2MAPK1ATMPLA2G10PLA2G2A | |
| SCHEMBL4670186 | 0.84 | EPHX2 (0.48) | ROCK2MAPK1ATMCYP2C9CYP2C19 | |
| SCHEMBL4670086 | 0.83 | ROCK2 (0.61) | ROCK2CYP2C19HPGDTSHR | |
| SCHEMBL4673552 | 0.79 | MAPK1 (0.49) | ROCK2MAPK1ATMHPGDMEN1 | |
| SCHEMBL4675102 | 0.78 | ALDH1A1 (0.42) | MAPK1ATMHPGDHCAR3MEN1 | |
| SCHEMBL4675660 | 0.76 | ROCK2 (0.56) | ROCK2MEN1KMT2AALDH1A1 | |
| SCHEMBL4670479 | 0.73 | ALDH1A1 (0.39) | MAPK1ATMHPGDMEN1KMT2A | |
| SCHEMBL4672091 | 0.72 | ALDH1A1 (0.47) | MAPK1ATMHPGDMEN1KMT2A | |
| SCHEMBL19643312 | 0.72 | ROCK2 (1.00) | ROCK2 | |
| SCHEMBL4670468 | 0.72 | PARP15 (0.42) | MAPK1ATMCYP2C9MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1054881-B1 | NOVEL SULFONAMIDE SUBSTITUTED CHROMAN DERIVATIVES USEFUL AS BETA-3 ADRENORECEPTOR AGONISTS | BAYER CORP (US) | 2008-07-30 | — | — | EP | disclosed |