Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | OPRM1 | P35372 | 5/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | KDR | P35968 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 2/20 | 0.34 |
| ▸ | HRH1 | P35367 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13903208 | 0.83 | GAA (0.47) | IDO1OPRM1SLC6A4KDRSLC6A3 | |
| SCHEMBL17900515 | 0.83 | GAA (0.47) | IDO1OPRM1SLC6A4KDRSLC6A3 | |
| SCHEMBL1327227 | 0.82 | OPRM1 (0.41) | IDO1KDM4EALDH1A1OPRM1SLC6A4 | |
| SCHEMBL493016 | 0.82 | OPRL1 (0.42) | IDO1KDM4EALDH1A1OPRM1SLC6A4 | |
| SCHEMBL6258817 | 0.81 | IDO1 (0.49) | IDO1OPRM1SLC6A4KDRSLC6A3 | |
| SCHEMBL2310032 | 0.80 | CARM1 (0.39) | IDO1ALDH1A1GAAL3MBTL1EPHX2 | |
| SCHEMBL645073 | 0.80 | KDM4E (0.36) | IDO1KDM4EALDH1A1OPRM1SLC6A4 | |
| Hydrochloric Acid SCHEMBL1328025 | 0.79 | CARM1 (0.38) | IDO1ALDH1A1GAAL3MBTL1EPHX2 | |
| SCHEMBL493239 | 0.79 | OPRD1 (0.45) | SLC6A4SLC6A3 | |
| SCHEMBL1326984 | 0.78 | KDM4E (0.40) | IDO1KDM4EALDH1A1OPRM1SLC6A4 |
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-8119633-B2 | N-{2-[2-(4-benzyl-4-hydroxy-piperidin-1-yl)-2-oxo-ethoxy]-ethyl}-N-ethyl-4-methoxy-2,3,6-trimethyl-phenylsulfonamide; condensing the N-carboxyalkyl phenylsulfonamide with the substituted piperidine; bradykinin receptor antagonists; analgesics; antidiabetics; angiogenesis inhibitors; rheumatic diseases | GRUENENTHAL GMBH (DE) | 2012-02-21 | — | — | US | disclosed |