Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.59 |
| ▸ | HTT | P42858 | 2/20 | 0.59 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.51 |
| ▸ | GFER | P55789 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | CES2 | O00748 | 1/20 | 0.50 |
| ▸ | CES1 | P23141 | 1/20 | 0.50 |
| ▸ | ALPL | P05186 | 1/20 | 0.50 |
| ▸ | ACACB | O00763 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 5/20 | 0.49 |
| ▸ | RAB9A | P51151 | 5/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | GAA | P10253 | 2/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.49 |
| ▸ | RELA | Q04206 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL1106971 | 0.86 | KDM4E (0.63) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL27553175 | 0.84 | ALDH1A1 (0.61) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL22618857 | 0.83 | ALDH1A1 (0.59) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL8581979 | 0.82 | KDM4E (0.55) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL8581974 | 0.82 | KDM4E (0.55) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL8580257 | 0.81 | KDM4C (0.66) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL8580260 | 0.81 | KDM4C (0.66) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL26460421 | 0.81 | ALDH1A1 (0.54) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL30044824 | 0.80 | KDM4E (0.56) | ALDH1A1KDM4EHTTTLR7GFER | |
| SCHEMBL27863520 | 0.80 | KDM4E (0.56) | ALDH1A1KDM4EHTTTLR7GFER |
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-2022140428-A2 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2022-06-30 | — | — | WO | disclosed |