Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.48 |
| ▸ | PGR | P06401 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | CAPN9 | O14815 | 1/20 | 0.44 |
| ▸ | CASP3 | P42574 | 1/20 | 0.44 |
| ▸ | PNMT | P11086 | 3/20 | 0.43 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.43 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.43 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.43 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.42 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.42 |
| ▸ | CHRNA3 | P32297 | 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 | |
|---|---|---|---|---|
| SCHEMBL17479578 | 1.00 | ALDH1A1 (0.51) | ALDH1A1LMNAGAAKMT2AEIF2AK2 | |
| SCHEMBL1347263 | 0.86 | CRBN (0.46) | ALDH1A1LMNAGAAKMT2AEIF2AK2 | |
| SCHEMBL1347469 | 0.78 | BRD4 (0.55) | ALDH1A1LMNAGAAKMT2ASMN1; SMN2 | |
| SCHEMBL12813209 | 0.77 | CHRNB4 (0.49) | ALDH1A1GAASMN1; SMN2PGRMAPT | |
| SCHEMBL11427314 | 0.77 | PGR (0.72) | ALDH1A1GAAKMT2ASMN1; SMN2PGR | |
| SCHEMBL434946 | 0.76 | BRD4 (0.53) | KMT2AMAPT | |
| SCHEMBL30293265 | 0.75 | BRD4 (0.57) | ALDH1A1 | |
| SCHEMBL7264599 | 0.75 | KMT2A (0.45) | LMNAKMT2AMAPT | |
| SCHEMBL17479629 | 0.75 | CA9 (0.44) | ALDH1A1 | |
| SCHEMBL6984175 | 0.75 | CHRNB4 (0.43) | ALDH1A1GAASMN1; SMN2PGRMAPT |
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 |
|---|---|---|---|---|---|---|---|
| EP-4093400-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | The Trustees of Princeton University (US) | 2022-11-30 | — | — | EP | disclosed |