Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | PPARG | P37231 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.39 |
| ▸ | USP2 | O75604 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KCNN4 | O15554 | 1/20 | 0.39 |
| ▸ | RNASEH1 | O60930 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | PLA2G2A | P14555 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL3456315 | 0.97 | SMN1; SMN2 (0.47) | SMN1; SMN2CYP1A2TP53MEN1KMT2A | |
| SCHEMBL3456118 | 0.91 | HPGD (0.42) | SMN1; SMN2KMT2APPARGALDH1A1NPSR1 | |
| SCHEMBL3455948 | 0.81 | HTT (0.46) | CYP1A2TP53ALDH1A1NPSR1KCNN4 | |
| SCHEMBL2217305 | 0.80 | HTT (0.46) | TP53MEN1KMT2AALDH1A1NPSR1 | |
| SCHEMBL2221002 | 0.79 | HTT (0.41) | TP53MEN1KMT2AALDH1A1NPSR1 | |
| SCHEMBL3456050 | 0.79 | KCNN4 (0.42) | SMN1; SMN2TP53ALDH1A1NPSR1KCNN4 | |
| SCHEMBL2219573 | 0.77 | HTT (0.43) | SMN1; SMN2TP53MEN1KMT2AALDH1A1 | |
| SCHEMBL20162908 | 0.77 | GAA (0.51) | TP53MEN1KMT2AALDH1A1NPSR1 | |
| SCHEMBL30036841 | 0.77 | GAA (0.51) | TP53MEN1KMT2AALDH1A1NPSR1 | |
| SCHEMBL1423244 | 0.76 | REN (0.40) | SMN1; SMN2MEN1KMT2AALDH1A1LMNA |
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-2250165-A1 | TRIAZOLE OXADIAZOLES DERIVATIVES | Merck Serono S.A. (CH) | 2010-11-17 | — | — | EP | disclosed |
| WO-2009080663-A1 | TRIAZOLE OXADIAZOLES DERIVATIVES | MERCK SERONO S.A. (CH) | 2009-07-02 | — | — | WO | disclosed |