Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACMSD | Q8TDX5 | 4/20 | 0.39 |
| ▸ | LTB4R2 | Q9NPC1 | 2/20 | 0.39 |
| ▸ | LTB4R | Q15722 | 1/20 | 0.38 |
| ▸ | HNF4A | P41235 | 2/20 | 0.38 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.38 |
| ▸ | DHFR | P00374 | 1/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 7/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3238250 | 0.87 | HDAC1 (0.41) | LTB4RHDAC1HDAC6HDAC3HDAC4 | |
| SCHEMBL3236466 | 0.76 | HDAC1 (0.41) | LTB4R2LTB4RHDAC1MGLLHDAC6 | |
| SCHEMBL1769746 | 0.74 | NPSR1 (0.53) | HDAC1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL10596450 | 0.74 | NPSR1 (0.53) | HDAC1ALDH1A1LMNAGAAMAPT | |
| SCHEMBL3236989 | 0.74 | HDAC1 (0.38) | LTB4R2LTB4RHDAC1KDM4EMGLL | |
| SCHEMBL4138868 | 0.73 | NPSR1 (0.55) | ALDH1A1LMNAMAPTHTTKMT2A | |
| SCHEMBL1162282 | 0.72 | ALDH1A1 (0.42) | LTB4R2KDM4EALDH1A1LMNAHTT | |
| SCHEMBL16369620 | 0.71 | ALDH1A1 (0.40) | HDAC1MEN1ALDH1A1LMNAMAPT | |
| SCHEMBL3242812 | 0.71 | ALDH1A1 (0.40) | HDAC1MEN1ALDH1A1LMNAMAPT | |
| Biphenyl SCHEMBL10596444 | 0.71 | LTB4R (0.55) | LTB4RHDAC1KDM4ELMNAGAA |
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 |