Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 3/20 | 0.41 |
| ▸ | C5AR1 | P21730 | 3/20 | 0.38 |
| ▸ | IDO1 | P14902 | 1/20 | 0.36 |
| ▸ | TDO2 | P48775 | 1/20 | 0.36 |
| ▸ | FFAR4 | Q5NUL3 | 2/20 | 0.35 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PDE5A | O76074 | 4/20 | 0.35 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.34 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.34 |
| ▸ | S1PR1 | P21453 | 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 | |
|---|---|---|---|---|
| SCHEMBL1327355 | 0.93 | AKR1C3 (0.40) | AKR1C3C5AR1IDO1TDO2FFAR4 | |
| SCHEMBL1328853 | 0.92 | AKR1C3 (0.42) | AKR1C3C5AR1IDO1TDO2FFAR4 | |
| SCHEMBL1328812 | 0.91 | AKR1C3 (0.45) | AKR1C3C5AR1IDO1TDO2ALDH1A1 | |
| SCHEMBL4824163 | 0.91 | AKR1C3 (0.43) | AKR1C3C5AR1MAPTL3MBTL1ALDH1A1 | |
| SCHEMBL1327872 | 0.88 | C5AR1 (0.39) | AKR1C3C5AR1FFAR4FFAR1MAPT | |
| SCHEMBL1327245 | 0.88 | SCN9A (0.39) | AKR1C3C5AR1HTTSMN1; SMN2L3MBTL1 | |
| SCHEMBL1329312 | 0.87 | C5AR1 (0.40) | AKR1C3C5AR1FFAR4FFAR1S1PR1 | |
| SCHEMBL1328955 | 0.86 | C5AR1 (0.37) | AKR1C3C5AR1FFAR4FFAR1LMNA | |
| SCHEMBL1327952 | 0.86 | KDM4E (0.41) | C5AR1FFAR4FFAR1MAPTSMN1; SMN2 | |
| SCHEMBL1327830 | 0.86 | MAPT (0.39) | C5AR1LMNAMAPTHTTSMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| US-7342115-B2 | Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology | NEUROGEN CORPORATION (US) | 2008-03-11 | — | — | US | claimed |
| US-7342115-B2 | Binding antagonist and arylpyridine for antiinflammatory agents, cardiovascular disorders and antagonist or agonist and for immunology | NEUROGEN CORPORATION (US) | 2008-03-11 | — | — | US | disclosed |