Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.44 |
| ▸ | SCNN1A | P37088 | 3/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.39 |
| ▸ | THPO | P40225 | 2/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | GLA | P06280 | 2/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.39 |
| ▸ | GMNN | O75496 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.39 |
| ▸ | ACSS2 | Q9NR19 | 6/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL2040435 | 0.89 | HTT (0.45) | HTTCYP1A2CYP2D6THPOHSD17B10 | |
| SCHEMBL2014255 | 0.89 | HTT (0.41) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2016331 | 0.88 | HTT (0.52) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2014823 | 0.88 | HTT (0.45) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2018304 | 0.87 | HTT (0.40) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2016749 | 0.87 | ACSS2 (0.41) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2016153 | 0.87 | HTT (0.44) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2018137 | 0.87 | ACSS2 (0.39) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| SCHEMBL2014097 | 0.87 | HTT (0.39) | HTTSCNN1ACYP1A2CYP2D6THPO | |
| Iodide SCHEMBL2019625 | 0.86 | HTT (0.43) | HTTSCNN1ACYP1A2CYP2D6THPO |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |
| WO-2011079087-A1 | ENAC BLOCKERS | GLAXO GROUP LIMITED (GB) | 2011-06-30 | — | — | WO | disclosed |