Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA4 | P22748 | 1/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | CES1 | P23141 | 1/20 | 0.46 |
| ▸ | PPARG | P37231 | 1/20 | 0.44 |
| ▸ | PPARA | Q07869 | 1/20 | 0.44 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | LDHA | P00338 | 1/20 | 0.43 |
| ▸ | DPP4 | P27487 | 1/20 | 0.41 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.41 |
| ▸ | EDNRB | P24530 | 1/20 | 0.41 |
| ▸ | EDNRA | P25101 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CRHBP | P24387 | 1/20 | 0.41 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | ACP3 | P15309 | 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 | |
|---|---|---|---|---|
| Anisole SCHEMBL8581158 | 0.94 | CA4 (0.44) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL7562607 | 0.91 | CA4 (0.61) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL28145757 | 0.91 | CA4 (0.61) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL250580 | 0.91 | CA4 (0.61) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL28177334 | 0.91 | CA4 (0.61) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL27691641 | 0.89 | CA4 (0.42) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL29027176 | 0.87 | L3MBTL1 (0.47) | PPARGPPARA | |
| Anisole SCHEMBL28945470 | 0.86 | CA4 (0.50) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL3738090 | 0.85 | CA4 (0.45) | CA4CES2CES1PPARGPPARA | |
| Anisole SCHEMBL4623600 | 0.85 | CA4 (0.45) | CA4CES2CES1PPARGPPARA |
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-20030119719-A1 | Use of endothelin conjugates in therapy, new endothelin conjugates, agents that contain the latter, and process for their production | DINKELBORG LUDGER (DE) | 2003-06-26 | — | — | US | disclosed |