Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNC | P24863 | 1/20 | 0.48 |
| ▸ | CDK8 | P49336 | 1/20 | 0.48 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.48 |
| ▸ | SCN9A | Q15858 | 4/20 | 0.47 |
| ▸ | CNR2 | P34972 | 2/20 | 0.43 |
| ▸ | CFTR | P13569 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | ATM | Q13315 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28940932 | 0.88 | CNR2 (0.49) | CCNCCDK8CDK19SCN9ACNR2 | |
| SCHEMBL28294317 | 0.87 | SCN9A (0.45) | CCNCCDK8CDK19SCN9AMAOB | |
| SCHEMBL28940894 | 0.85 | CCNC (0.39) | CCNCCDK8CDK19SCN9ACNR2 | |
| SCHEMBL28940978 | 0.83 | SCN9A (0.39) | CCNCCDK8CDK19SCN9ACNR2 | |
| SCHEMBL21379449 | 0.82 | SCN9A (0.44) | CCNCCDK8CDK19SCN9ACNR2 | |
| SCHEMBL28292566 | 0.82 | MAOB (0.49) | SCN9AMAOBL3MBTL1 | |
| SCHEMBL28294334 | 0.80 | LOXL2 (0.46) | SCN9ACNR2CFTR | |
| SCHEMBL28292586 | 0.80 | SCN9A (0.44) | SCN9ACFTRMAOBCYP2C9HPGD | |
| SCHEMBL28940985 | 0.80 | SCN9A (0.44) | SCN9ACFTRMAOBCYP2C9HPGD | |
| SCHEMBL28284688 | 0.80 | CCNC (0.43) | CCNCCDK8CDK19ALDH1A1CYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | claimed |
| CN-109689647-B | Bicyclic heteroaryl substituted compounds | 百时美施贵宝公司 | 2023-01-20 | — | — | CN | disclosed |
| CN-109689647-A | The compound that bicyclic heteroaryl replaces | 百时美施贵宝公司 | 2019-04-26 | — | — | CN | disclosed |