Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 1/20 | 0.44 |
| ▸ | CTSK | P43235 | 2/20 | 0.42 |
| ▸ | CAPN1 | P07384 | 1/20 | 0.41 |
| ▸ | CTSB | P07858 | 1/20 | 0.40 |
| ▸ | CTSS | P25774 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 6/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.39 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.39 |
| ▸ | FOLH1 | Q04609 | 1/20 | 0.38 |
| ▸ | GPR142 | Q7Z601 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 2/20 | 0.36 |
| ▸ | DPP8 | Q6V1X1 | 2/20 | 0.36 |
| ▸ | DPP9 | Q86TI2 | 2/20 | 0.36 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | LCK | P06239 | 1/20 | 0.35 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | THRB | P10828 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL756368 | 0.89 | FOLH1 (0.47) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL18731295 | 0.89 | FOLH1 (0.47) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL14864797 | 0.89 | CTSK (0.42) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL23324594 | 0.88 | SCN9A (0.50) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL25888951 | 0.88 | SCN9A (0.50) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL888810 | 0.86 | CTSK (0.43) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL10122815 | 0.86 | CTSK (0.43) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL14886205 | 0.86 | CTSK (0.43) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL12762220 | 0.85 | CNR2 (0.41) | CNR2CTSKCAPN1CTSBCTSS | |
| SCHEMBL16574843 | 0.85 | CNR2 (0.41) | CNR2CTSKCAPN1CTSBCTSS |
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 |
|---|---|---|---|---|---|---|---|
| EP-2242750-B1 | CONFORMATIONALLY RESTRICTED BIPHENYL DERIVATIVES FOR USE AS HEPATITIS C VIRUS INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2013-04-24 | — | — | EP | disclosed |