Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 13/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 11/20 | 0.70 |
| ▸ | HPGD | P15428 | 9/20 | 0.70 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.70 |
| ▸ | GLA | P06280 | 7/20 | 0.70 |
| ▸ | GAA | P10253 | 6/20 | 0.70 |
| ▸ | HTT | P42858 | 5/20 | 0.70 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.70 |
| ▸ | TSHR | P16473 | 3/20 | 0.70 |
| ▸ | LMNA | P02545 | 2/20 | 0.70 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.70 |
| ▸ | BCHE | P06276 | 1/20 | 0.64 |
| ▸ | ACHE | P22303 | 1/20 | 0.64 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | MAOA | P21397 | 1/20 | 0.53 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL20158977 | 0.84 | KDM4E (0.68) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL20159056 | 0.78 | ACHE (1.00) | KDM4EALDH1A1HPGDHSD17B10HTT | |
| SCHEMBL24200439 | 0.74 | KDM4E (0.55) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL13564050 | 0.73 | BCHE (0.67) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL31232939 | 0.72 | BCHE (0.54) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL11047658 | 0.72 | ALDH1A1 (0.81) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL20159028 | 0.70 | KDM4E (0.54) | KDM4EALDH1A1HPGDHSD17B10GLA | |
| SCHEMBL30102487 | 0.70 | DYRK1A (1.00) | BCHEACHEMAOADYRK1AHASPIN | |
| SCHEMBL2216160 | 0.70 | DYRK1A (1.00) | BCHEACHEMAOADYRK1AHASPIN | |
| SCHEMBL20158935 | 0.69 | KDM4E (0.50) | KDM4EALDH1A1HPGDHSD17B10GLA |
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 |