Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TNIK | Q9UKE5 | 1/20 | 0.38 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.37 |
| ▸ | SUV39H2 | Q9H5I1 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 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 | |
|---|---|---|---|---|
| SCHEMBL4187144 | 0.89 | ALDH1A1 (0.38) | ACHEKDM4ELMNAALDH1A1MAPT | |
| SCHEMBL4189834 | 0.83 | MAPK1 (0.37) | KDM4ELMNAALDH1A1MAPTNPSR1 | |
| SCHEMBL4185269 | 0.81 | KDM4E (0.34) | KDM4EALDH1A1MAPTHSD17B10PDPK1 | |
| SCHEMBL4177972 | 0.80 | SLC10A2 (0.33) | KDM4EHSP90AA1HSP90AB1 | |
| SCHEMBL4177980 | 0.78 | S1PR1 (0.48) | KDM4ELMNAALDH1A1MAPTATM | |
| SCHEMBL4177976 | 0.78 | KMT2A (0.31) | KDM4EPDPK1 | |
| SCHEMBL4182671 | 0.76 | KDR (0.35) | KDM4EALDH1A1MAPTBRD4HSP90AA1 | |
| SCHEMBL4178311 | 0.71 | PDE10A (0.35) | KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL4191730 | 0.69 | SLC10A2 (0.33) | ALDH1A1MAPT | |
| SCHEMBL4182845 | 0.69 | MAPT (0.34) | KDM4ELMNAALDH1A1MAPTHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009014730-A1 | MACROCYCLIC SERINE PROTEASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2009-01-29 | — | — | WO | disclosed |