Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | MPI | P34949 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 3/20 | 0.44 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.43 |
| ▸ | ESR1 | P03372 | 3/20 | 0.43 |
| ▸ | USP7 | Q93009 | 2/20 | 0.42 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | PDE4B | Q07343 | 3/20 | 0.39 |
| ▸ | PDE4A | P27815 | 2/20 | 0.39 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.39 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL23940766 | 0.89 | ESR2 (0.47) | KDM4EMAPTESR2ESR1USP7 | |
| SCHEMBL23940767 | 0.82 | ESR2 (0.46) | KDM4EALDH1A1MAPTHPGDESR2 | |
| SCHEMBL27353212 | 0.81 | PTGS1 (0.51) | MEN1MAPTKMT2ABACE1 | |
| SCHEMBL11328974 | 0.80 | ALDH1A1 (0.57) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL15856369 | 0.79 | METAP2 (0.38) | MEN1MAPTKMT2APDE4BPDE4A | |
| SCHEMBL30230314 | 0.78 | MEN1 (0.45) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL28992830 | 0.78 | MEN1 (0.45) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL15261306 | 0.78 | ALDH1A1 (0.59) | KDM4EMEN1ALDH1A1MAPTHPGD | |
| SCHEMBL1292805 | 0.78 | ALOX5 (0.59) | KMT2ABACE1ESR2ESR1ALOX5 | |
| SCHEMBL11666732 | 0.78 | ALOX5 (0.53) | KDM4EMEN1ALDH1A1MAPTHPGD |
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-2021211982-A2 | REGIOSELECTIVE SYNTHESIS OF SUBSTITUTED COMPOUNDS | OREGON STATE UNIVERSITY (US) | 2021-10-21 | — | — | WO | disclosed |