Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | SSTR4 | P31391 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.37 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
| ▸ | CARM1 | Q86X55 | 1/20 | 0.36 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2913723 | 0.85 | CYP2C19 (0.47) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL28396688 | 0.83 | MRGPRX4 (0.49) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL2615140 | 0.83 | ACHE (0.46) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL2615139 | 0.83 | ACHE (0.46) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL29669768 | 0.81 | L3MBTL1 (0.50) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL473085 | 0.81 | L3MBTL1 (0.50) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL6172318 | 0.81 | CES2 (0.45) | CYP1A2CYP3A4CYP2C19MAPTNPSR1 | |
| SCHEMBL1100780 | 0.80 | KDM4E (0.46) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL2191597 | 0.79 | PDE10A (0.45) | CYP1A2CYP3A4CYP2C19MAPTCYP2C9 | |
| SCHEMBL27580041 | 0.79 | KEAP1 (0.44) | CYP1A2CYP3A4CYP2C19CYP2C9L3MBTL1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107250126-B | Long-acting dipeptidyl peptidase-IV inhibitor, application and preparation method thereof | 四川科伦博泰生物医药股份有限公司 | 2019-10-25 | — | — | CN | disclosed |
| CN-107250126-A | Long-acting dipeptidyl peptidase-IV inhibitor, application and preparation method thereof | 四川科伦博泰生物医药股份有限公司 | 2017-10-13 | — | — | CN | disclosed |