Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | BCHE | P06276 | 2/20 | 0.39 |
| ▸ | HTR6 | P50406 | 2/20 | 0.39 |
| ▸ | USP30 | Q70CQ3 | 4/20 | 0.38 |
| ▸ | PIK3CD | O00329 | 1/20 | 0.37 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.37 |
| ▸ | FPR3 | P25089 | 1/20 | 0.37 |
| ▸ | FPR2 | P25090 | 1/20 | 0.37 |
| ▸ | BTK | Q06187 | 2/20 | 0.36 |
| ▸ | ANO1 | Q5XXA6 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | JAK2 | O60674 | 1/20 | 0.35 |
| ▸ | JAK1 | P23458 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 1/20 | 0.35 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.35 |
| ▸ | PBK | Q96KB5 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29855767 | 1.00 | HDAC4 (0.40) | HDAC4HDAC6BCHEHTR6USP30 | |
| SCHEMBL22613075 | 0.90 | BCHE (0.40) | HDAC4HDAC6BCHEHTR6USP30 | |
| SCHEMBL22613074 | 0.90 | BCHE (0.40) | HDAC4HDAC6BCHEHTR6USP30 | |
| SCHEMBL10099184 | 0.90 | HTR6 (0.40) | HDAC4HDAC6BCHEHTR6USP30 | |
| SCHEMBL22613184 | 0.90 | JAK3 (0.34) | JAK2JAK1 | |
| SCHEMBL22613183 | 0.90 | JAK3 (0.34) | JAK2JAK1 | |
| SCHEMBL10099173 | 0.89 | JAK3 (0.45) | HDAC4HDAC6BCHEHTR6USP30 | |
| SCHEMBL22620168 | 0.88 | JAK3 (0.49) | JAK1 | |
| SCHEMBL22620101 | 0.88 | JAK3 (0.49) | JAK1 | |
| SCHEMBL22620117 | 0.87 | JAK2 (0.46) | HDAC4HDAC6BCHEHTR6USP30 |
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-2020223728-A1 | SUBSTITUTED PYRROLOPYRIDINES AS JAK INHIBITORS | ACLARIS THERAPEUTICS, INC. (US) | 2020-11-05 | — | — | WO | disclosed |