Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | ABCB1 | P08183 | 8/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | CASP1 | P29466 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | BLM | P54132 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | KCNE1 | P15382 | 1/20 | 0.34 |
| ▸ | KCNQ1 | P51787 | 1/20 | 0.34 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7253745 | 0.94 | KCNE1 (0.41) | HTTABCB1KDM4EALDH1A1GAA | |
| Hydrochloric Acid SCHEMBL7253248 | 0.88 | ABCB1 (0.41) | ABCB1KDM4EALDH1A1GAAHPGD | |
| SCHEMBL7253793 | 0.78 | HTT (0.49) | HTTABCB1KDM4EALDH1A1GAA | |
| SCHEMBL13199629 | 0.74 | KCNE1 (0.37) | ABCB1KCNE1KCNQ1 | |
| SCHEMBL13199561 | 0.74 | ABCB1 (0.45) | ABCB1CYP3A4KCNE1KCNQ1 | |
| SCHEMBL13199622 | 0.73 | ABCB1 (0.44) | ABCB1ALDH1A1GAACYP3A4KCNE1 | |
| SCHEMBL13199624 | 0.72 | ABCB1 (0.44) | ABCB1CYP3A4KCNE1KCNQ1 | |
| SCHEMBL13199632 | 0.72 | NR1D1 (0.36) | ABCB1ALDH1A1GAAHIF1AKCNE1 | |
| SCHEMBL13199558 | 0.72 | ABCB1 (0.43) | ABCB1ALDH1A1CYP3A4KCNE1KCNQ1 | |
| SCHEMBL13199568 | 0.71 | ABCB1 (0.41) | ABCB1CYP3A4KCNE1KCNQ1 |
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-2003014113-A1 | NOVEL BENZOPYRAN COMPOUNDS AND PROCESS FOR THEIR PREPARATION AND USE | GLENMARK PHARMACEUTICALS LIMITED (IN) | 2003-02-20 | — | — | WO | disclosed |