Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | XIAP | P98170 | 1/20 | 0.41 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 4/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.35 |
| ▸ | CSNK2A2 | P19784 | 1/20 | 0.35 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL3484094 | 0.78 | XIAP (0.36) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483775 | 0.78 | HDAC1 (0.48) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483840 | 0.77 | RAB9A (0.50) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483727 | 0.75 | RAB9A (0.43) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483730 | 0.75 | RAB9A (0.43) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483445 | 0.73 | HDAC1 (0.46) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483079 | 0.72 | RAB9A (0.47) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3484166 | 0.71 | RAB9A (0.41) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483720 | 0.71 | HDAC1 (0.41) | HDAC1HDAC2HDAC6MAPTRAB9A | |
| SCHEMBL3483333 | 0.70 | KDM4E (0.41) | HDAC1HDAC2HDAC6MAPTRAB9A |
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-2049200-A2 | NOVEL INHIBITORS OF BETA-LACTAMASE | MethylGene Inc. (CA) | 2009-04-22 | — | — | EP | disclosed |
| WO-2008073142-A2 | NOVEL INHIBITORS OF BETA-LACTAMASE | MERCK & CO., INC. (US) | 2008-06-19 | — | — | WO | disclosed |