Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 8/20 | 0.37 |
| ▸ | ESR1 | P03372 | 6/20 | 0.37 |
| ▸ | ENPP2 | Q13822 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.32 |
| ▸ | MMP3 | P08254 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL4521078 | 0.82 | ENPP2 (0.39) | ENPP2MMP3KDM4ETDP1 | |
| SCHEMBL1466419 | 0.80 | RXRB (0.40) | ENPP2MMP3KDM4ETDP1 | |
| SCHEMBL16526955 | 0.77 | ESR1 (0.31) | ESR2ESR1 | |
| SCHEMBL17656382 | 0.75 | KDM1A (0.34) | ESR2ESR1ENPP2 | |
| SCHEMBL21218921 | 0.72 | ENPP2 (0.40) | ESR2ESR1ENPP2L3MBTL1MMP3 | |
| SCHEMBL28840767 | 0.70 | PRMT5 (0.38) | ENPP2MMP3KDM4ETDP1 | |
| SCHEMBL17656383 | 0.70 | OPRM1 (0.40) | — | |
| SCHEMBL1789393 | 0.69 | NPC1 (0.40) | ESR2ESR1L3MBTL1KDM4E | |
| SCHEMBL29790934 | 0.68 | ENPP2 (0.37) | ENPP2L3MBTL1MMP3KDM4ETDP1 | |
| SCHEMBL27582186 | 0.68 | ENPP2 (0.37) | ENPP2L3MBTL1MMP3KDM4ETDP1 |
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-2674428-B1 | Modulators of ATP-binding cassette transporters | VERTEX PHARMA (US) | 2016-04-06 | — | — | EP | disclosed |