Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | CHRM4 | P08173 | 6/20 | 0.39 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | BCHE | P06276 | 1/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | SMPD3 | Q9NY59 | 2/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.38 |
| ▸ | PIM3 | Q86V86 | 1/20 | 0.38 |
| ▸ | PIM2 | Q9P1W9 | 1/20 | 0.38 |
| ▸ | LATS1 | O95835 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | TSHR | P16473 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29600541 | 1.00 | ALDH1A1 (0.39) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL24324008 | 0.96 | SMPD3 (0.41) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL1326312 | 0.78 | ALDH1A1 (0.44) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL6214234 | 0.75 | PDE10A (0.48) | ALDH1A1SMN1; SMN2MAPTKDM4EPIM2 | |
| SCHEMBL29600540 | 0.74 | MAPT (0.41) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL24324092 | 0.74 | MAPT (0.41) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL1326991 | 0.74 | KDM4E (0.39) | ALDH1A1SMN1; SMN2GAACHRM4MAPT | |
| SCHEMBL24269963 | 0.73 | PDE10A (0.42) | CHRM4MAPTKDM4EL3MBTL1SMPD3 | |
| SCHEMBL24269964 | 0.73 | PDE10A (0.42) | CHRM4MAPTKDM4EL3MBTL1SMPD3 | |
| SCHEMBL24323734 | 0.73 | ALDH1A1 (0.40) | ALDH1A1SMN1; SMN2GAACHRM4MAPT |
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-116601158-A | Modulators of cystic fibrosis transmembrane conductance regulator | 弗特克斯药品有限公司 | 2023-08-15 | — | — | CN | disclosed |
| WO-2022076622-A2 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |