Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 4/20 | 0.73 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.54 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.54 |
| ▸ | PARP1 | P09874 | 1/20 | 0.54 |
| ▸ | GABRA1 | P14867 | 4/20 | 0.54 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.54 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.54 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.54 |
| ▸ | SLC6A5 | Q9Y345 | 1/20 | 0.54 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.53 |
| ▸ | HTR6 | P50406 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL8359258 | 0.87 | ACHE (0.71) | ACHEHDAC1HDAC6PARP1GABRA1 | |
| SCHEMBL8359525 | 0.86 | ACHE (0.73) | ACHEHDAC1HDAC6GABRA1GABRA2 | |
| SCHEMBL8359252 | 0.81 | SIGMAR1 (0.56) | ACHEPARP1 | |
| SCHEMBL30029262 | 0.79 | PARP1 (0.70) | ACHEPARP1 | |
| SCHEMBL2625346 | 0.78 | SLC6A5 (0.80) | ACHEGABRA1GABRA2SLC6A5AKR1B1 | |
| SCHEMBL8359307 | 0.77 | SLC6A5 (0.74) | ACHEHDAC1HDAC6PARP1SLC6A5 | |
| SCHEMBL633048 | 0.74 | ACHE (1.00) | ACHEHDAC1HDAC6AKR1B1 | |
| SCHEMBL29915094 | 0.74 | SLC6A5 (0.61) | ACHEHDAC1HDAC6SLC6A5 | |
| SCHEMBL27002308 | 0.74 | SLC6A5 (0.61) | ACHEHDAC1HDAC6SLC6A5 | |
| SCHEMBL8359419 | 0.73 | PARP1 (0.74) | PARP1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7247641-B2 | Compounds, derivatives, compositions, preparation and uses | MGI GP, INC. (US) | 2007-07-24 | — | — | US | disclosed |
| US-7247641-B2 | Compounds, derivatives, compositions, preparation and uses | MGI GP, INC. (US) | 2007-07-24 | — | — | US | disclosed |
| WO-2003014121-A9 | COMPOUNDS, DERIVATIVES, COMPOSITIONS, PREPARATION AND USES | GUILFORD PHARM INC (US) | 2004-03-25 | — | — | WO | disclosed |
| WO-2003014121-A1 | COMPOUNDS, DERIVATIVES, COMPOSITIONS, PREPARATION AND USES | GUILFORD PHARMACEUTICALS INC. (US) | 2003-02-20 | — | — | WO | disclosed |