Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.40 |
| ▸ | MAPT | P10636 | 4/20 | 0.38 |
| ▸ | PRMT5 | O14744 | 1/20 | 0.38 |
| ▸ | WDR77 | Q9BQA1 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.37 |
| ▸ | CD38 | P28907 | 1/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.36 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.36 |
| ▸ | SYK | P43405 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 1/20 | 0.36 |
| ▸ | RXFP1 | Q9HBX9 | 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 | |
|---|---|---|---|---|
| SCHEMBL24324614 | 0.96 | ADORA2A (0.39) | ALDH1A1KDM4ECD38ADORA2AADORA1 | |
| SCHEMBL29600599 | 0.96 | ADORA2A (0.39) | ALDH1A1KDM4ECD38ADORA2AADORA1 | |
| SCHEMBL31014743 | 0.79 | NPC1 (0.40) | KDM4EMEN1KMT2ACD38SMN1; SMN2 | |
| SCHEMBL24323742 | 0.78 | NPC1 (0.41) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL21044370 | 0.77 | ALDH1A1 (0.42) | ALDH1A1MAPTKDM4EL3MBTL1MEN1 | |
| SCHEMBL24270196 | 0.76 | ADORA2A (0.43) | ALDH1A1MAPTKDM4EL3MBTL1ADORA2A | |
| SCHEMBL24270195 | 0.76 | ADORA2A (0.43) | ALDH1A1MAPTKDM4EL3MBTL1ADORA2A | |
| SCHEMBL20031580 | 0.74 | RBP4 (0.40) | CD38 | |
| SCHEMBL1326312 | 0.74 | ALDH1A1 (0.44) | ALDH1A1MAPTKDM4EL3MBTL1MEN1 | |
| SCHEMBL24324092 | 0.73 | MAPT (0.41) | ALDH1A1MAPTKDM4EL3MBTL1MEN1 |
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-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |