Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.46 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | PARP10 | Q53GL7 | 1/20 | 0.46 |
| ▸ | PARP11 | Q9NR21 | 1/20 | 0.46 |
| ▸ | MME | P08473 | 10/20 | 0.44 |
| ▸ | ACE | P12821 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | CES1 | P23141 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL1252255 | 0.83 | GAA (0.62) | MAPTTSHRGAAPDPK1PARP1 | |
| SCHEMBL1252254 | 0.83 | GAA (0.62) | MAPTTSHRGAAPDPK1PARP1 | |
| SCHEMBL2080900 | 0.83 | GAA (0.62) | MAPTTSHRGAAPDPK1PARP1 | |
| SCHEMBL17648067 | 0.82 | TSHR (0.46) | MAPTTSHRPDPK1PARP1PARP10 | |
| SCHEMBL7425901 | 0.79 | KDM4E (0.47) | MAPTTSHRKDM4EALDH1A1LMNA | |
| SCHEMBL1531662 | 0.78 | GAA (0.69) | MAPTGAAMMEACEALDH1A1 | |
| SCHEMBL29831598 | 0.78 | GAA (0.69) | MAPTGAAMMEACEALDH1A1 | |
| SCHEMBL1150614 | 0.78 | GAA (0.69) | MAPTGAAMMEACEALDH1A1 | |
| SCHEMBL444953 | 0.78 | GAA (0.69) | MAPTGAAMMEACEALDH1A1 | |
| SCHEMBL22800232 | 0.78 | MME (0.45) | MAPTTSHRGAAPDPK1PARP1 |
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-3203840-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2017-08-16 | — | — | EP | disclosed |
| WO-2016057572-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | MILLER MARK THOMAS (US) | 2016-04-14 | — | — | WO | disclosed |