Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 3/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | HPGD | P15428 | 2/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.52 |
| ▸ | GLA | P06280 | 1/20 | 0.52 |
| ▸ | TRPM4 | Q8TD43 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 3/20 | 0.46 |
| ▸ | NQO2 | P16083 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | MITF | O75030 | 1/20 | 0.41 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.41 |
| ▸ | NCOA3 | Q9Y6Q9 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | BLM | P54132 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11045803 | 0.91 | CYP1A2 (0.61) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL19691146 | 0.91 | TRPM4 (0.48) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL27998358 | 0.90 | ALDH1A1 (0.46) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL5749296 | 0.84 | ALDH1A1 (0.65) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL27651681 | 0.82 | ALDH1A1 (0.63) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL10499754 | 0.81 | KDM4E (0.55) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL28207840 | 0.79 | ALDH1A1 (0.50) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL31294814 | 0.79 | ALDH1A1 (0.50) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL770722 | 0.78 | CYP1A2 (0.70) | KDM4EALDH1A1HSD17B10MEN1KMT2A | |
| SCHEMBL1803539 | 0.78 | ABCG2 (0.54) | KDM4EALDH1A1HSD17B10MEN1KMT2A |
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 |