Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 12/20 | 0.41 |
| ▸ | SLC6A9 | P48067 | 5/20 | 0.36 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.35 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.35 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.35 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.35 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.35 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.35 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.35 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.35 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL903973 | 0.79 | HDAC3 (0.36) | ACACBHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL24467815 | 0.77 | ACACB (0.41) | ACACBSLC6A9HDAC3HDAC4HDAC1 | |
| SCHEMBL904191 | 0.75 | ACACB (0.39) | ACACBSLC6A9HDAC3HDAC4HDAC1 | |
| SCHEMBL15075660 | 0.73 | ACACB (0.43) | ACACBSLC6A9 | |
| SCHEMBL8203125 | 0.71 | ACACB (0.50) | ACACBHDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL24467741 | 0.70 | CHRNB4 (0.45) | ACACB | |
| SCHEMBL24421152 | 0.69 | POLB (0.41) | — | |
| SCHEMBL23744161 | 0.69 | ACACB (0.43) | ACACBSLC6A9 | |
| SCHEMBL24968246 | 0.69 | ACACB (0.46) | ACACBSLC6A9 | |
| SCHEMBL19439052 | 0.69 | ESR2 (0.46) | ACACB |
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-2012041158-A1 | TRICYCLIC COMPOUND, PREPARATION METHOD AND PHARMACEUTICAL USE THEREOF | 上海恒瑞医药有限公司 (CN) | 2012-04-05 | — | — | WO | disclosed |