Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMO | Q99835 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10004707 | 0.86 | SMO (0.57) | SMOALDH1A1TP53ALOX15NPSR1 | |
| SCHEMBL10004519 | 0.76 | SMO (0.59) | SMOALDH1A1TP53ALOX15NPSR1 | |
| SCHEMBL10003922 | 0.76 | SMO (0.58) | SMOALDH1A1NPSR1HSD17B10TSHR | |
| SCHEMBL10004176 | 0.75 | SMO (0.59) | SMOALDH1A1TP53ALOX15NPSR1 | |
| SCHEMBL10004400 | 0.73 | SMO (0.74) | SMOALDH1A1TP53ALOX15NPSR1 | |
| SCHEMBL1060921 | 0.72 | SMO (0.44) | SMOALDH1A1HSD17B10TSHR | |
| SCHEMBL1056908 | 0.70 | SMO (0.64) | SMOALDH1A1 | |
| SCHEMBL10004444 | 0.68 | SMO (0.67) | SMOALDH1A1NPSR1GAAMAPT | |
| SCHEMBL10004768 | 0.68 | SMO (0.53) | SMOALDH1A1NPSR1TSHRGAA | |
| SCHEMBL10004638 | 0.67 | SMO (0.61) | SMOALDH1A1HSD17B10MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2471793-A1 | FUSED HETEROCYCLIC RING DERIVATIVE AND USE THEREOF | Takeda Pharmaceutical Company Limited (JP) | 2012-07-04 | — | — | EP | disclosed |