Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | CALCRL | Q16602 | 1/20 | 0.34 |
| ▸ | ACACB | O00763 | 2/20 | 0.34 |
| ▸ | ACACA | Q13085 | 2/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.33 |
| ▸ | MGAM | O43451 | 1/20 | 0.33 |
| ▸ | RPS6KA3 | P51812 | 1/20 | 0.33 |
| ▸ | RPS6KA2 | Q15349 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | CFTR | P13569 | 1/20 | 0.33 |
| ▸ | PLD1 | Q13393 | 5/20 | 0.33 |
| ▸ | PLD2 | O14939 | 4/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.32 |
| ▸ | TDP2 | O95551 | 1/20 | 0.32 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.32 |
| ▸ | HPGDS | O60760 | 1/20 | 0.32 |
| ▸ | FASN | P49327 | 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 | |
|---|---|---|---|---|
| SCHEMBL18152160 | 1.00 | HDAC8 (0.37) | HDAC8CALCRLACACBACACAMAPKAPK2 | |
| SCHEMBL18153855 | 0.96 | HDAC8 (0.35) | HDAC8CALCRLACACBACACAMAPKAPK2 | |
| SCHEMBL18153955 | 0.96 | HDAC8 (0.35) | HDAC8CALCRLACACBACACAMAPKAPK2 | |
| SCHEMBL18152156 | 0.84 | HDAC8 (0.33) | HDAC8CALCRLHDAC1HDAC6 | |
| SCHEMBL18152094 | 0.84 | HDAC8 (0.33) | HDAC8CALCRLHDAC1HDAC6 | |
| SCHEMBL18152134 | 0.83 | HDAC6 (0.33) | CALCRLHDAC6 | |
| SCHEMBL18152102 | 0.83 | CALCRL (0.39) | HDAC8CALCRLHDAC6 | |
| SCHEMBL18152050 | 0.83 | CALCRL (0.39) | HDAC8CALCRLHDAC6 | |
| SCHEMBL18152198 | 0.83 | HDAC6 (0.40) | CALCRLRPS6KA3RPS6KA2HDAC6 | |
| SCHEMBL18152145 | 0.83 | HDAC6 (0.40) | CALCRLRPS6KA3RPS6KA2HDAC6 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2016168598-A1 | 3-SPIROCYCLIC-6-HYDROXAMIC ACID TETRALINS AS HDAC INHIBITORS | FORMA THERAPEUTICS, INC. (US) | 2016-10-20 | — | — | WO | claimed |
| WO-2016168598-A1 | 3-SPIROCYCLIC-6-HYDROXAMIC ACID TETRALINS AS HDAC INHIBITORS | FORMA THERAPEUTICS, INC. (US) | 2016-10-20 | — | — | WO | disclosed |