Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCAT2 | O15382 | 2/20 | 0.50 |
| ▸ | BACE1 | P56817 | 2/20 | 0.45 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.43 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL975812 | 0.85 | BCAT2 (0.55) | BCAT2BACE1ALDH1A1HPGDHSD17B10 | |
| SCHEMBL27967445 | 0.83 | BCAT2 (0.42) | BCAT2BACE1ALOX5ALDH1A1HPGD | |
| SCHEMBL4881197 | 0.81 | BCAT2 (0.60) | BCAT2ALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL28429428 | 0.80 | CA12 (0.52) | BACE1ALOX5ALDH1A1HPGDHSD17B10 | |
| SCHEMBL6842022 | 0.79 | BCAT2 (0.63) | BCAT2ALDH1A1HPGDHSD17B10BCL2L1 | |
| SCHEMBL2000711 | 0.78 | HSD17B10 (0.46) | ALDH1A1HPGDHSD17B10MAPTTSHR | |
| SCHEMBL5590480 | 0.74 | HNF4A (0.48) | BACE1ALOX5ALDH1A1HPGDHSD17B10 | |
| SCHEMBL27718034 | 0.74 | HNF4A (0.53) | BACE1ALOX5ALDH1A1HPGDHSD17B10 | |
| SCHEMBL722165 | 0.74 | BCAT2 (0.47) | BCAT2ALDH1A1HPGDHSD17B10MAPT | |
| SCHEMBL4143761 | 0.74 | BCAT2 (0.56) | BCAT2ALDH1A1HPGDHSD17B10MAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2205070-A1 | N-HYDROXY-NAPHTHALENE DICARBOXAMIDE AND N-HYDROXY-BIPHENYL-DICARBOXAMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS | Merck Sharp & Dohme Corp. (US) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009045385-A1 | N-HYDROXY-NAPHTHALENE DICARBOXAMIDE AND N-HYDROXY-BIPHENYL-DICARBOXAMIDE COMPOUNDS AS HISTONE DEACETYLASE INHIBITORS | MERCK & CO., INC. (US) | 2009-04-09 | — | — | WO | disclosed |