Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 7/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 4/20 | 0.33 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.33 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL7998525 | 0.97 | HDAC1 (0.33) | HDAC6HDAC1HDAC8GRIN1GRIN2B | |
| SCHEMBL7999089 | 0.93 | HDAC1 (0.34) | HDAC6HDAC1HDAC8GRIN1GRIN2B | |
| SCHEMBL8007763 | 0.86 | GRIN1 (0.35) | HDAC6HDAC1HDAC8GRIN1GRIN2B | |
| SCHEMBL8007749 | 0.82 | POLB (0.39) | GRIN1GRIN2B | |
| SCHEMBL7998527 | 0.81 | GRIN1 (0.35) | HDAC6HDAC1HDAC8GRIN1GRIN2B | |
| SCHEMBL8007765 | 0.81 | POLB (0.38) | GRIN1GRIN2B | |
| SCHEMBL8008284 | 0.81 | POLB (0.38) | GRIN1GRIN2B | |
| SCHEMBL8010417 | 0.80 | POLB (0.41) | GRIN1GRIN2BTDP1 | |
| SCHEMBL7998444 | 0.80 | L3MBTL1 (0.32) | HDAC6HDAC1HDAC8 | |
| SCHEMBL10293079 | 0.79 | FAAH (0.30) | HDAC6ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009134987-A1 | DIFLUOROMETHYL-CONTAINING MACROCYCLIC COMPOUNDS AS HEPATITIS C VIRUS INHIBITORS | ENANTA PHARMACEUTICALS, INC. (US) | 2009-11-05 | — | — | WO | disclosed |