Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM2B | Q8NHM5 | 2/20 | 0.53 |
| ▸ | USP2 | O75604 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.51 |
| ▸ | GRM3 | Q14832 | 3/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.48 |
| ▸ | MEN1 | O00255 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.48 |
| ▸ | RAB9A | P51151 | 1/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | PKM | P14618 | 1/20 | 0.48 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | PROKR1 | Q8TCW9 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10195742 | 0.90 | ALDH1A1 (0.54) | KDM2BKMT2AGRM3ALDH1A1MEN1 | |
| SCHEMBL15317634 | 0.86 | KMT2A (0.57) | KMT2AGRM3ALDH1A1MEN1HTT | |
| SCHEMBL10195743 | 0.85 | HPGD (0.61) | KMT2AALDH1A1MEN1HTTRAB9A | |
| SCHEMBL10194851 | 0.85 | GRM3 (0.65) | KMT2AGRM3ALDH1A1MEN1RAB9A | |
| SCHEMBL18754048 | 0.82 | NAMPT (0.58) | KDM2BUSP2KMT2AALDH1A1MEN1 | |
| SCHEMBL10195745 | 0.82 | KMT2A (0.47) | KMT2AGRM3ALDH1A1MEN1PKM | |
| SCHEMBL10194852 | 0.82 | KMT2A (0.51) | KMT2AGRM3ALDH1A1MEN1PKM | |
| SCHEMBL15317783 | 0.81 | L3MBTL1 (0.42) | KMT2AGRM3ALDH1A1SMN1; SMN2HPGD | |
| SCHEMBL10195593 | 0.80 | KMT2A (0.52) | KMT2AGRM3HPGDPROKR1 | |
| SCHEMBL10196674 | 0.80 | CYP19A1 (0.50) | KMT2APROKR1 |
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 |