Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H4 | Q96RI1 | 16/20 | 0.48 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.43 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL24451779 | 0.90 | NR1H4 (0.46) | NR1H4NR1I2CYP2C9CYP2C19HDAC1 | |
| SCHEMBL22352662 | 0.88 | NR1H4 (0.48) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452240 | 0.85 | NR1H4 (0.58) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452393 | 0.82 | NR1H4 (0.51) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452408 | 0.81 | NR1H4 (0.43) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL22348191 | 0.81 | NR1H4 (0.68) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452480 | 0.81 | NR1H4 (0.51) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452395 | 0.81 | NR1H4 (0.47) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24451786 | 0.81 | NR1H4 (0.44) | NR1H4NR1I2CYP2C9CYP2C19 | |
| SCHEMBL24452472 | 0.80 | NR1H4 (0.42) | 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 |