Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.52 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | TP53 | P04637 | 3/20 | 0.47 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.46 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.46 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL24035608 | 0.83 | MEN1 (0.52) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL4054492 | 0.83 | HTT (0.62) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL15317760 | 0.83 | KDM4E (0.46) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL11402474 | 0.82 | MEN1 (0.52) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL7036876 | 0.81 | PDE4B (0.51) | KDM4ESMN1; SMN2HSD17B10HTTMEN1 | |
| Bromide SCHEMBL5751833 | 0.81 | HTT (0.61) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL4061176 | 0.81 | MAPT (0.52) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL10195704 | 0.79 | PDE4B (0.50) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL14679185 | 0.79 | KDM4E (0.46) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR | |
| SCHEMBL4054889 | 0.78 | PDE4B (0.44) | KDM4ESMN1; SMN2ALDH1A1HSD17B10TSHR |
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-2655357-B1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO SA (CH) | 2016-06-22 | — | — | EP | disclosed |
| WO-2012084704-A1 | INDAZOLYL TRIAZOLE DERIVATIVES AS IRAK INHIBITORS | MERCK SERONO S.A. (CH) | 2012-06-28 | — | — | WO | disclosed |