Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TACR2 | P21452 | 2/20 | 0.49 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.46 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.46 |
| ▸ | BCHE | P06276 | 6/20 | 0.46 |
| ▸ | ACHE | P22303 | 6/20 | 0.46 |
| ▸ | FAAH | O00519 | 3/20 | 0.46 |
| ▸ | CES1 | P23141 | 2/20 | 0.46 |
| ▸ | DAGLA | Q9Y4D2 | 1/20 | 0.46 |
| ▸ | HDAC3 | O15379 | 4/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.44 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.44 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.44 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.44 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.44 |
| ▸ | MMP13 | P45452 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.41 |
| ▸ | HTR1A | P08908 | 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 | |
|---|---|---|---|---|
| SCHEMBL7537229 | 0.90 | HDAC3 (0.49) | TACR2HDAC1HDAC2BCHEACHE | |
| SCHEMBL7533012 | 0.85 | FAAH (0.45) | FAAHCES1DAGLAHDAC6 | |
| SCHEMBL7533880 | 0.85 | TACR2 (0.52) | TACR2 | |
| SCHEMBL7530247 | 0.84 | FAAH (0.44) | HDAC1FAAHCES1DAGLAHDAC3 | |
| SCHEMBL7528389 | 0.83 | MAPT (0.42) | TACR2FAAHCES1DAGLA | |
| SCHEMBL7529866 | 0.83 | FAAH (0.43) | TACR2FAAHCES1DAGLAHDAC6 | |
| SCHEMBL7530914 | 0.83 | FAAH (0.43) | HDAC1FAAHCES1DAGLAHDAC3 | |
| SCHEMBL7535321 | 0.83 | FAAH (0.43) | HDAC1FAAHCES1DAGLAHDAC3 | |
| SCHEMBL7536597 | 0.83 | FAAH (0.43) | FAAHCES1DAGLA | |
| SCHEMBL7535950 | 0.82 | CTSL (0.49) | HDAC1HDAC2ACHEFAAHCES1 |
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-2002023784-A2 | CYSTEINE PROTEASE INHIBITORS | AXYS PHARMACEUTICALS, INC. (US) | 2002-03-21 | — | — | WO | disclosed |