Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 4/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.39 |
| ▸ | RELA | Q04206 | 2/20 | 0.39 |
| ▸ | NPC1 | O15118 | 3/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 3/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.38 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.36 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL29587460 | 0.86 | SLC6A3 (0.39) | NFKB1NFKB2RELAHDAC3HDAC1 | |
| SCHEMBL29587203 | 0.84 | PPARG (0.39) | HPGDNFKB1NFKB2RELAALDH1A1 | |
| SCHEMBL29587169 | 0.82 | HDAC3 (0.45) | HPGDNFKB1NFKB2RELAALDH1A1 | |
| SCHEMBL29587175 | 0.82 | FAAH (0.36) | NPC1RAB9AHDAC3HDAC1HDAC2 | |
| SCHEMBL29586866 | 0.82 | LMNA (0.42) | HPGDNPC1ALDH1A1RAB9ALMNA | |
| SCHEMBL29587290 | 0.82 | HDAC3 (0.51) | NFKB1NFKB2RELAALDH1A1RAB9A | |
| SCHEMBL29588212 | 0.81 | RAB9A (0.48) | HPGDNFKB1NFKB2RELANPC1 | |
| SCHEMBL29586783 | 0.80 | HDAC3 (0.44) | HPGDNFKB1NFKB2RELAHDAC3 | |
| SCHEMBL29586900 | 0.80 | HDAC3 (0.44) | HPGDNFKB1NFKB2RELAHDAC3 | |
| SCHEMBL29587076 | 0.79 | SLC6A3 (0.39) | NFKB1NFKB2RELANPC1RAB9A |
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-2022120048-A1 | HDAC INHIBITORS | UNIVERSITY OF PITTSBURGH - OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) | 2022-06-09 | — | — | WO | disclosed |