Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.40 |
| ▸ | AHR | P35869 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.38 |
| ▸ | HDAC4 | P56524 | 4/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.38 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 4/20 | 0.38 |
| ▸ | HDAC10 | Q969S8 | 4/20 | 0.38 |
| ▸ | HDAC11 | Q96DB2 | 4/20 | 0.38 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 4/20 | 0.38 |
| ▸ | HDAC9 | Q9UKV0 | 4/20 | 0.38 |
| ▸ | HDAC5 | Q9UQL6 | 4/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | GLA | P06280 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | IMPDH2 | P12268 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL20147219 | 0.83 | AHR (0.42) | KDM4EAHRHDAC3HDAC4HDAC1 | |
| SCHEMBL2214815 | 0.82 | KDM4E (0.47) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27962902 | 0.77 | HDAC3 (0.47) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL27962882 | 0.77 | PTGER1 (0.48) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2218077 | 0.76 | KDM4E (0.49) | KDM4EHPGDHSD17B10ALDH1A1LMNA | |
| SCHEMBL24200425 | 0.76 | ALKBH5 (0.41) | KDM4EAHRHPGDHSD17B10ALDH1A1 | |
| SCHEMBL27962930 | 0.74 | ALDH1A1 (0.56) | KDM4EHPGDHSD17B10ALDH1A1LMNA | |
| SCHEMBL29217020 | 0.73 | KDM4E (0.46) | KDM4EHPGDHSD17B10ALDH1A1LMNA | |
| SCHEMBL25411401 | 0.73 | MAPT (0.49) | KDM4EHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2214686 | 0.72 | KDM4E (0.45) | KDM4EHPGDHSD17B10ALDH1A1LMNA |
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-3538529-B1 | SELECTIVE INHIBITORS OF GENOTOXIC STRESS-INDUCED IKK/NF-KB PATHWAYS | MAX DELBRUECK CENTRUM FUER MOLEKULARE MEDIZIN HELMHOLTZ GEMEINSCHAFT (DE) | 2022-01-19 | — | — | EP | disclosed |