Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACACB | O00763 | 2/20 | 0.39 |
| ▸ | GPR119 | Q8TDV5 | 2/20 | 0.36 |
| ▸ | ADH1B | P00325 | 3/20 | 0.33 |
| ▸ | ADH1A | P07327 | 3/20 | 0.33 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.33 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.33 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.33 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.33 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.33 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.33 |
| ▸ | CHRM4 | P08173 | 2/20 | 0.32 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.32 |
| ▸ | KCNH2 | Q12809 | 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 | |
|---|---|---|---|---|
| SCHEMBL20064573 | 0.80 | GRIN2D (0.41) | GPR119HDAC6SLC6A9 | |
| SCHEMBL20064017 | 0.79 | HRH4 (0.44) | ACACBGPR119MAPK1KCNH2 | |
| SCHEMBL17972943 | 0.72 | TSHR (0.39) | ACACBGPR119HDAC6MAPK1KCNH2 | |
| SCHEMBL16472351 | 0.72 | ACACB (0.39) | ACACBGPR119OPRK1HDAC6MAPK1 | |
| SCHEMBL17973025 | 0.71 | HRH3 (0.41) | ACACBGPR119KCNH2SLC6A9AOC3 | |
| SCHEMBL12457553 | 0.71 | ACACB (0.41) | ACACBGPR119HDAC6KCNH2SLC6A9 | |
| SCHEMBL24962247 | 0.70 | ACACB (0.39) | ACACBGPR119MAPK1KCNH2SLC6A9 | |
| SCHEMBL21227806 | 0.69 | JAK3 (0.45) | ACACB | |
| SCHEMBL16302107 | 0.69 | KDM4E (0.45) | ACACBGPR119HDAC3HDAC4HDAC1 | |
| SCHEMBL12490730 | 0.69 | OPRK1 (0.52) | GPR119OPRK1KCNH2 |
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-2018069863-A1 | 1,3 DI-SUBSTITUTED CYCLOBUTANE OR AZETIDINE DERIVATIVES AS HEMATOPOIETIC PROSTAGLANDIN D SYNTHASE INHIBITORS | GLAXOSMITHKLINE INTELLECTUAL PROPERTY DEVELOPMENT LIMITED (GB) | 2018-04-19 | — | — | WO | disclosed |