Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPK1 | P28482 | 2/20 | 0.65 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.53 |
| ▸ | CA1 | P00915 | 1/20 | 0.52 |
| ▸ | CA2 | P00918 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.51 |
| ▸ | P4HTM | Q9NXG6 | 3/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 3/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | LCK | P06239 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL1545257 | 1.00 | MAPK1 (0.65) | MAPK1DYRK1ACA1CA2KDM4E | |
| SCHEMBL17007009 | 0.90 | MAPK1 (0.57) | MAPK1DYRK1ACA1CA2KDM4E | |
| SCHEMBL13075575 | 0.85 | MAPK1 (0.61) | MAPK1DYRK1ACA1CA2KDM4E | |
| SCHEMBL24969494 | 0.85 | MAPK1 (0.61) | MAPK1DYRK1ACA1CA2KDM4E | |
| SCHEMBL15994646 | 0.85 | MAPK1 (0.47) | MAPK1DYRK1ACA1CA2KDM4E | |
| SCHEMBL31620610 | 0.84 | MAPK1 (0.59) | MAPK1DYRK1AKDM4EL3MBTL1P4HTM | |
| SCHEMBL10270980 | 0.84 | MAPK1 (0.59) | MAPK1DYRK1AKDM4EL3MBTL1P4HTM | |
| SCHEMBL30827080 | 0.83 | MAPK1 (0.54) | MAPK1DYRK1AKDM4EL3MBTL1MAPT | |
| SCHEMBL22529696 | 0.83 | MAPK1 (0.54) | MAPK1DYRK1AKDM4EL3MBTL1MAPT | |
| SCHEMBL2187078 | 0.82 | DRD3 (0.47) | MAPK1CA1CA2KDM4EL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-119137107-A | Macrocyclic inhibitors of ATP citrate lyase | 艾斯柏伦治疗公司 | 2024-12-13 | — | — | CN | disclosed |