Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EDNRA | P25101 | 10/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | EDNRB | P24530 | 5/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6541388 | 0.90 | EDNRA (0.43) | EDNRAKDM4EALDH1A1MAPTEDNRB | |
| SCHEMBL6541874 | 0.88 | EDNRA (0.53) | EDNRACYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL6542090 | 0.86 | EDNRA (0.45) | EDNRACYP1A2CYP2C9CYP2C19HTT | |
| SCHEMBL6542606 | 0.86 | EDNRA (0.43) | EDNRAHTTKDM4EALDH1A1MAPT | |
| SCHEMBL6542684 | 0.85 | EDNRA (0.42) | EDNRAKDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL6542057 | 0.84 | EDNRA (0.51) | EDNRAHTTALDH1A1MAPTEDNRB | |
| SCHEMBL6542600 | 0.83 | EDNRA (0.44) | EDNRAHTTKDM4EALDH1A1HSD17B10 | |
| SCHEMBL6541832 | 0.83 | EDNRA (0.46) | EDNRAHTTKDM4EALDH1A1EDNRB | |
| SCHEMBL6542752 | 0.83 | EDNRA (0.49) | EDNRAHTTKDM4EALDH1A1MAPT | |
| SCHEMBL7828674 | 0.82 | EDNRA (0.47) | EDNRAEDNRB |
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-1009743-B1 | CERTAIN BENZOTHIAZINE DIOXIDE ENDOTHELIN ANTAGONISTS AND PROCESSES FOR THEIR PREPARATION | WARNER LAMBERT CO (US) | 2004-06-30 | — | — | EP | claimed |