Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DPP4 | P27487 | 1/20 | 0.37 |
| ▸ | DPP8 | Q6V1X1 | 1/20 | 0.37 |
| ▸ | DPP9 | Q86TI2 | 1/20 | 0.37 |
| ▸ | DPP7 | Q9UHL4 | 1/20 | 0.37 |
| ▸ | ACE | P12821 | 4/20 | 0.36 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.34 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.34 |
| ▸ | NAMPT | P43490 | 1/20 | 0.31 |
| ▸ | AR | P10275 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | HSP90AA1 | P07900 | 2/20 | 0.30 |
| ▸ | HSP90AB1 | P08238 | 2/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28265026 | 0.88 | ACE (0.36) | DPP4DPP8DPP9DPP7ACE | |
| SCHEMBL28039622 | 0.86 | PARP1 (0.38) | DPP9DPP7ACENAMPTTSHR | |
| SCHEMBL27822279 | 0.85 | CHRNB4 (0.36) | ACEKCNH2HRH3BLMTSHR | |
| SCHEMBL28152852 | 0.85 | CHRNB4 (0.36) | ACEKCNH2HRH3BLMTSHR | |
| SCHEMBL28186716 | 0.83 | ACE (0.34) | DPP4DPP8DPP9DPP7ACE | |
| SCHEMBL28187445 | 0.81 | NOTUM (0.36) | ACEKCNH2HRH3BLMTSHR | |
| SCHEMBL27528106 | 0.79 | KDM4E (0.42) | NAMPTCYP2C19 | |
| SCHEMBL27920541 | 0.75 | ACE (0.41) | ACEHSP90AA1HSP90AB1 | |
| SCHEMBL27842630 | 0.74 | ACE (0.39) | ACEHSP90AA1HSP90AB1CYP1A2CYP2D6 | |
| SCHEMBL28361507 | 0.74 | ACE (0.40) | ACEKCNH2HRH3HSP90AA1HSP90AB1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107200749-B | DNA-PK inhibitor | 沃泰克斯药物股份有限公司 | 2019-09-03 | — | — | CN | disclosed |
| CN-107200749-A | DNA PK inhibitor | 沃泰克斯药物股份有限公司 | 2017-09-26 | — | — | CN | disclosed |
| CN-105246883-B | DNA-PK inhibitors | 沃泰克斯药物股份有限公司 | 2017-07-21 | — | — | CN | disclosed |
| CN-105246883-A | Dna-pk inhibitors | VERTEX PHARMA | 2016-01-13 | — | — | CN | disclosed |