Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CACNA2D1 | P54289 | 1/20 | 0.43 |
| ▸ | CACNA1B | Q00975 | 1/20 | 0.43 |
| ▸ | CACNB1 | Q02641 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | CASP1 | P29466 | 1/20 | 0.39 |
| ▸ | CASP4 | P49662 | 1/20 | 0.39 |
| ▸ | CASP5 | P51878 | 1/20 | 0.39 |
| ▸ | SLC6A7 | Q99884 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 3/20 | 0.39 |
| ▸ | HTR2C | P28335 | 2/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.38 |
| ▸ | DRD3 | P35462 | 1/20 | 0.38 |
| ▸ | PLD1 | Q13393 | 1/20 | 0.38 |
| ▸ | DRD4 | P21917 | 1/20 | 0.36 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL27365980 | 0.78 | BPTF (0.40) | CACNA2D1CACNA1BCACNB1PARP1CASP1 | |
| SCHEMBL303641 | 0.77 | PLD1 (0.59) | SLC6A7HTR2CHTR2APLD1 | |
| SCHEMBL29999093 | 0.77 | PLD1 (0.59) | SLC6A7HTR2CHTR2APLD1 | |
| Hydrochloric Acid SCHEMBL23123869 | 0.76 | PLD1 (0.58) | SLC6A7HTR2CHTR2APLD1 | |
| Hydrochloric Acid SCHEMBL29701046 | 0.76 | PLD1 (0.58) | SLC6A7HTR2CHTR2APLD1 | |
| Hydrochloric Acid SCHEMBL4812837 | 0.76 | PLD1 (0.58) | SLC6A7HTR2CHTR2APLD1 | |
| SCHEMBL5199030 | 0.74 | PDE10A (0.46) | SLC6A7RIPK1 | |
| Hydrochloric Acid SCHEMBL7652417 | 0.73 | HRH4 (0.46) | CACNA2D1CACNA1BCACNB1PARP1CASP1 | |
| SCHEMBL5656510 | 0.72 | CHRNB2 (0.54) | CASP1CASP4CASP5SLC6A7HTR2C | |
| SCHEMBL27366890 | 0.72 | DRD2 (0.46) | CACNA2D1CACNA1BCACNB1PARP1CASP1 |
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-2022270994-A1 | NOVEL BIFUNCTIONAL HETEROCYCLIC COMPOUND HAVING BTK DEGRADATION FUNCTION VIA UBIQUITIN PROTEASOME PATHWAY, AND USE THEREOF | 한국화학연구원 | 2022-12-29 | — | — | WO | disclosed |