Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.39 |
| ▸ | S1PR3 | Q99500 | 1/20 | 0.39 |
| ▸ | ACSS2 | Q9NR19 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.37 |
| ▸ | NLRP3 | Q96P20 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 2/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | SCNN1A | P37088 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2021620 | 0.91 | HTT (0.45) | HTTS1PR3ACSS2MAPTNPC1 | |
| SCHEMBL2020165 | 0.90 | ACSS2 (0.46) | HTTACSS2CYP2C9TSHRMEN1 | |
| SCHEMBL2017836 | 0.86 | HTT (0.46) | HTTTP53ACSS2LMNAMEN1 | |
| SCHEMBL12635756 | 0.85 | HTT (0.49) | HTTACSS2TSHRMEN1KMT2A | |
| SCHEMBL2014471 | 0.84 | MAPT (0.52) | HTTTSHRMAPTNPC1NLRP3 | |
| SCHEMBL2018430 | 0.84 | ACSS2 (0.42) | HTTS1PR3ACSS2MEN1KMT2A | |
| SCHEMBL2020396 | 0.84 | HTT (0.48) | HTTTP53ACSS2LMNAMEN1 | |
| SCHEMBL2018438 | 0.83 | SCNN1A (0.44) | HTTTP53ACSS2MAPTSCNN1A | |
| SCHEMBL2015541 | 0.83 | HTT (0.46) | HTTACSS2TSHR | |
| SCHEMBL2040435 | 0.83 | HTT (0.45) | HTTTP53ACSS2LMNACYP1A2 |
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 |