Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 20/20 | 0.51 |
| ▸ | NR1I2 | O75469 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL22348159 | 0.84 | NR1H4 (0.67) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22348285 | 0.78 | NR1H4 (0.66) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22348325 | 0.77 | NR1H4 (0.67) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22348179 | 0.77 | NR1H4 (0.72) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22353807 | 0.76 | NR1H4 (0.73) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22348251 | 0.74 | NR1H4 (0.65) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22352701 | 0.74 | NR1H4 (0.60) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22353941 | 0.71 | NR1H4 (0.51) | NR1H4 | |
| SCHEMBL24452280 | 0.69 | NR1H4 (0.50) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22352795 | 0.69 | NR1H4 (0.71) | NR1H4NR1I2CYP2C9CYP2C19 |
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-2020168148-A1 | SUBSTITUTED BICYCLIC COMPOUNDS AS FARNESOID X RECEPTOR MODULATORS | BRISTOL-MYERS SQUIBB COMPANY (US) | 2020-08-20 | — | — | WO | disclosed |