Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.43 |
| ▸ | HPGD | P15428 | 4/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | TSHR | P16473 | 2/20 | 0.43 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | CASP1 | P29466 | 1/20 | 0.43 |
| ▸ | CASP7 | P55210 | 1/20 | 0.43 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.41 |
| ▸ | HTT | P42858 | 2/20 | 0.41 |
| ▸ | GLA | P06280 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | GPR55 | Q9Y2T6 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ADORA1 | P30542 | 6/20 | 0.40 |
| ▸ | VCP | P55072 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL1734504 | 0.86 | KDM4E (0.51) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734127 | 0.82 | KDM4E (0.57) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1735703 | 0.81 | KDM4E (0.49) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734521 | 0.81 | HRH1 (0.52) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734332 | 0.79 | KDM4E (0.60) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734267 | 0.79 | PIK3CB (0.57) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734473 | 0.79 | KDM4E (0.48) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734154 | 0.79 | IDH1 (0.54) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1735729 | 0.79 | KDM4E (0.48) | KDM4EALDH1A1HPGDHSD17B10TSHR | |
| SCHEMBL1734424 | 0.78 | KDM4E (0.53) | KDM4EALDH1A1HPGDHSD17B10TSHR |
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-1891018-B1 | MODULATORS OF ATP-BINDING CASSETTE TRANSPORTERS | VERTEX PHARMA (US) | 2011-11-16 | — | — | EP | claimed |
| WO-2011131686-A1 | A THERMALLY CONTROLLED ASSEMBLY | NAPATECH A/S (DK) | 2011-10-27 | — | — | WO | claimed |