Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | GFER | P55789 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CCR3 | P51677 | 2/20 | 0.35 |
| ▸ | ESRRG | P62508 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 2/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | RAD52 | P43351 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL6983850 | 0.80 | MEN1 (0.39) | ALDH1A1GFERMAPTMEN1KMT2A | |
| Hydrochloric Acid SCHEMBL6980238 | 0.79 | ALDH1A1 (0.40) | ALDH1A1GFERMAPTMEN1KMT2A | |
| SCHEMBL8309041 | 0.78 | HTR2A (0.41) | ALDH1A1GFERMEN1KMT2AATM | |
| SCHEMBL8716967 | 0.69 | MEN1 (0.36) | ALDH1A1CYP3A4MAPTMEN1KMT2A | |
| SCHEMBL6980360 | 0.67 | SLC18A3 (0.40) | SMN1; SMN2HTT | |
| SCHEMBL8716163 | 0.65 | ALOX5 (0.31) | CYP3A4MEN1KMT2A | |
| SCHEMBL8720009 | 0.64 | MAPT (0.44) | ALDH1A1MAPTMEN1KMT2AMAPK1 | |
| SCHEMBL6985836 | 0.64 | DRD2 (0.40) | ALDH1A1CYP3A4CYP2C9GFERMAPT | |
| Hydrochloric Acid SCHEMBL6980227 | 0.63 | DRD2 (0.40) | ALDH1A1CYP3A4CYP2C9GFERMAPT | |
| SCHEMBL8874977 | 0.61 | MAPT (0.35) | MAPTMEN1KMT2AATMMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0923575-A1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | Takeda Chemical Industries, Ltd. (JP) | 1999-06-23 | — | — | EP | disclosed |
| WO-1998008842-A1 | CYCLIC ETHER COMPOUNDS AS SODIUM CHANNEL MODULATORS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1998-03-05 | — | — | WO | disclosed |