Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.53 |
| ▸ | NSD2 | O96028 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | MET | P08581 | 1/20 | 0.46 |
| ▸ | MST1R | Q04912 | 1/20 | 0.46 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.44 |
| ▸ | STAT1 | P42224 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.44 |
| ▸ | RELA | Q04206 | 1/20 | 0.44 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | JAK2 | O60674 | 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 | |
|---|---|---|---|---|
| SCHEMBL30334651 | 0.88 | KDM4E (0.50) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL3436679 | 0.79 | MAPT (0.56) | MAPTKDM4ENSD2ALDH1A1KDM4C | |
| SCHEMBL12729869 | 0.77 | KDM4E (0.58) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL30570094 | 0.76 | MAPT (0.53) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL9989118 | 0.76 | KDM4E (0.57) | MAPTKDM4ENSD2ALDH1A1NOTUM | |
| SCHEMBL18339237 | 0.76 | MAPT (0.56) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL29306052 | 0.74 | KDM4C (0.45) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL29159245 | 0.74 | MAOA (0.41) | MAPTKDM4ENSD2ALDH1A1NOTUM | |
| SCHEMBL18588067 | 0.74 | KDM4E (0.48) | MAPTKDM4ENSD2ALDH1A1MET | |
| SCHEMBL24664403 | 0.73 | MAPT (0.53) | MAPTKDM4ENSD2ALDH1A1KDM4C |
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 |
|---|---|---|---|---|---|---|---|
| EP-4337642-A1 | ETHACRYNIC ACID DERIVATIVES AS INHIBITORS OF MPRO PROTEASE AND SARS-COV-2 REPLICATION | Universite Euro-Mediterraneenne de Fes (MA) | 2024-03-20 | — | — | EP | disclosed |
| WO-2022240277-A1 | ETHACRYNIC ACID DERIVATIVES AS INHIBITORS OF MPRO PROTEASE AND SARS-COV-2 REPLICATION | UNIVERSITE EURO-MEDITERRANEENNE DE FES (MA) | 2022-11-17 | — | — | WO | disclosed |