Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 5/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.42 |
| ▸ | GAA | P10253 | 2/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.40 |
| ▸ | HTT | P42858 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.40 |
| ▸ | MEN1 | O00255 | 3/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | NPY1R | P25929 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | NPY2R | P49146 | 1/20 | 0.39 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2910004 | 0.92 | ALDH1A1 (0.45) | KMT2AALDH1A1NPSR1GAARECQL | |
| SCHEMBL2905631 | 0.87 | LMNA (0.51) | ALDH1A1NPSR1GAARECQLLMNA | |
| SCHEMBL639847 | 0.86 | KDM4E (0.50) | KMT2AALDH1A1NPSR1GAARECQL | |
| SCHEMBL2907759 | 0.84 | PLA2G2A (0.43) | KMT2AALDH1A1GAALMNATP53 | |
| SCHEMBL2909757 | 0.83 | KCNN4 (0.47) | KMT2AALDH1A1NPSR1GAARECQL | |
| SCHEMBL2907639 | 0.83 | PLA2G2A (0.44) | KMT2AALDH1A1NPSR1GAARECQL | |
| SCHEMBL2901560 | 0.80 | NPSR1 (0.42) | KMT2AALDH1A1NPSR1GAARECQL | |
| SCHEMBL638729 | 0.80 | PLA2G2A (0.43) | KMT2ANPSR1LMNAKDM4EHTT | |
| SCHEMBL638972 | 0.80 | BRD4 (0.41) | KMT2ANPSR1LMNAKDM4EHTT | |
| SCHEMBL2906933 | 0.80 | NPSR1 (0.53) | KMT2AALDH1A1NPSR1GAARECQL |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2121627-B1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2010-08-18 | — | — | EP | claimed |
| EP-2121627-A1 | BENZIMIDAZOLE DERIVATIVES | Merck Patent GmbH (DE) | 2009-11-25 | — | — | EP | claimed |
| WO-2008101586-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2008-08-28 | — | — | WO | claimed |