Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DGAT1 | O75907 | 9/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 7/20 | 0.67 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.67 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.67 |
| ▸ | FFAR4 | Q5NUL3 | 11/20 | 0.58 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.53 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL10325681 | 0.79 | DGAT1 (0.62) | DGAT1KCNH2CYP2C9CYP3A4SOAT1 | |
| SCHEMBL10380812 | 0.78 | DGAT1 (0.61) | DGAT1KCNH2CYP2C9CYP3A4SOAT1 | |
| SCHEMBL16483455 | 0.74 | FFAR4 (1.00) | FFAR4 | |
| SCHEMBL10146413 | 0.74 | DGAT1 (0.88) | DGAT1KCNH2CYP2C9CYP3A4FFAR4 | |
| SCHEMBL902149 | 0.74 | DGAT1 (0.62) | DGAT1KCNH2CYP2C9CYP3A4SOAT1 | |
| SCHEMBL10147297 | 0.73 | DGAT1 (0.62) | DGAT1KCNH2CYP2C9CYP3A4FFAR4 | |
| SCHEMBL16482950 | 0.73 | FFAR4 (1.00) | FFAR4 | |
| SCHEMBL10326050 | 0.72 | DGAT1 (0.66) | DGAT1KCNH2CYP2C9CYP3A4SOAT1 | |
| SCHEMBL10380811 | 0.71 | DGAT1 (0.55) | DGAT1KCNH2CYP2C9CYP3A4SOAT1 | |
| SCHEMBL16482946 | 0.71 | FFAR4 (1.00) | FFAR4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012009217-A1 | SPIROCYCLIC COMPOUNDS | MERCK SHARP & DOHME CORP. (US) | 2012-01-19 | — | — | WO | disclosed |