Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GCK | P35557 | 5/20 | 0.36 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.34 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | GSTO1 | P78417 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | SLC12A5 | Q9H2X9 | 1/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PYGL | P06737 | 1/20 | 0.32 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL3233610 | 0.92 | KDM4E (0.38) | KDM4EGCKLMNAMAPK14PTGDR2 | |
| SCHEMBL3233744 | 0.82 | KMT2A (0.47) | KDM4ELMNAMAPK14NPC1RAB9A | |
| SCHEMBL3232041 | 0.81 | HDAC1 (0.34) | KDM4ENPC1RAB9AHDAC3HDAC1 | |
| SCHEMBL3237150 | 0.81 | HDAC1 (0.41) | KDM4ELMNANPC1RAB9AHDAC3 | |
| SCHEMBL3238619 | 0.78 | KDM4E (0.34) | KDM4ELMNAMAPK14HDAC3HDAC1 | |
| SCHEMBL3232050 | 0.78 | HDAC3 (0.40) | NPC1RAB9AHDAC3HDAC1ALDH1A1 | |
| SCHEMBL3227664 | 0.78 | HDAC1 (0.32) | MAPK14PTGDR2HDAC3HDAC1 | |
| SCHEMBL3240737 | 0.78 | MAPK14 (0.48) | LMNAMAPK14NPC1RAB9AHDAC1 | |
| SCHEMBL3235671 | 0.76 | GRM1 (0.44) | MAPK14NPC1RAB9AHDAC1TDP1 | |
| SCHEMBL3262238 | 0.73 | HDAC3 (0.35) | HDAC3HDAC1TDP1 |
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-2010028193-A1 | COMPOUNDS INCLUDING PIMELIC ACID DERIVATIVES AS HDAC INHIBITORS | REPLIGEN CORPORATION (US) | 2010-03-11 | — | — | WO | disclosed |