Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.54 |
| ▸ | PDE4A | P27815 | 1/20 | 0.48 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.48 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.48 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.48 |
| ▸ | CRBN | Q96SW2 | 4/20 | 0.44 |
| ▸ | DDB1 | Q16531 | 2/20 | 0.44 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.39 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.38 |
| ▸ | SYK | P43405 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL14458009 | 1.00 | ALDH1A1 (0.54) | ALDH1A1SMN1; SMN2PDE4APDE4BPDE4C | |
| SCHEMBL22201142 | 0.81 | TP53 (0.51) | ALDH1A1PDE4APDE4BPDE4CPDE4D | |
| SCHEMBL4142288 | 0.81 | PDE4A (0.44) | ALDH1A1SMN1; SMN2PDE4APDE4BPDE4C | |
| SCHEMBL3497573 | 0.81 | ESR2 (0.56) | PDE4APDE4BPDE4CPDE4DHDAC2 | |
| SCHEMBL22190402 | 0.81 | PDE4A (0.44) | ALDH1A1SMN1; SMN2PDE4APDE4BPDE4C | |
| SCHEMBL23878342 | 0.81 | TDP1 (0.46) | PDE4APDE4BPDE4CPDE4DCRBN | |
| SCHEMBL22039449 | 0.81 | TDP1 (0.46) | PDE4APDE4BPDE4CPDE4DCRBN | |
| SCHEMBL22201147 | 0.81 | PDE4A (0.44) | ALDH1A1SMN1; SMN2PDE4APDE4BPDE4C | |
| SCHEMBL22201140 | 0.81 | PDE4A (0.44) | ALDH1A1SMN1; SMN2PDE4APDE4BPDE4C | |
| SCHEMBL7237762 | 0.81 | TDP1 (0.46) | PDE4APDE4BPDE4CPDE4DCRBN |
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-2020141734-A1 | METHOD FOR PREPARING CHIRAL GAMMA-LACTAM COMPOUND AND METAL COMPLEX THEREFOR | 기초과학연구원 | 2020-07-09 | — | — | WO | disclosed |