Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 9/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.59 |
| ▸ | POLB | P06746 | 5/20 | 0.59 |
| ▸ | MEN1 | O00255 | 4/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.59 |
| ▸ | RAB9A | P51151 | 3/20 | 0.59 |
| ▸ | NPC1 | O15118 | 1/20 | 0.59 |
| ▸ | LMNA | P02545 | 1/20 | 0.59 |
| ▸ | NQO2 | P16083 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 5/20 | 0.50 |
| ▸ | GAA | P10253 | 2/20 | 0.50 |
| ▸ | THRB | P10828 | 2/20 | 0.47 |
| ▸ | BLM | P54132 | 2/20 | 0.47 |
| ▸ | CASP6 | P55212 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL30717269 | 0.89 | KMT2A (0.68) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL30717271 | 0.89 | KMT2A (0.68) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL30717270 | 0.89 | KMT2A (0.68) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL1160711 | 0.89 | KMT2A (0.68) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL10435667 | 0.87 | KDM4E (0.70) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL19073465 | 0.82 | KMT2A (0.59) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL19545391 | 0.81 | MEN1 (0.58) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL1579980 | 0.81 | ALDH1A1 (0.58) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL1160600 | 0.81 | ALDH1A1 (0.58) | KDM4EALDH1A1KMT2APOLBMEN1 | |
| SCHEMBL10214298 | 0.80 | MEN1 (0.87) | KDM4EALDH1A1KMT2APOLBMEN1 |
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-2744336-B1 | PROCESS AND INTERMEDIATES FOR PREPARING MACROLACTAMS | MERCK SHARP & DOHME (US) | 2017-07-05 | — | — | EP | disclosed |
| WO-2013027794-A1 | NOVEL COMPOUND AND USE THEREOF AS PDE10 INHIBITOR | 田辺三菱製薬株式会社 (JP) | 2013-02-28 | — | — | WO | disclosed |