Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 3/20 | 0.41 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.41 |
| ▸ | PDE2A | O00408 | 1/20 | 0.41 |
| ▸ | PDE1A | P54750 | 1/20 | 0.41 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.41 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | PDE4A | P27815 | 2/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22625798 | 1.00 | ALDH1A1 (0.46) | ALDH1A1TSHRMAPK1SMN1; SMN2ADORA2A | |
| SCHEMBL14802479 | 0.91 | ALDH1A1 (0.52) | ALDH1A1TSHRMAPK1SMN1; SMN2ADORA2A | |
| SCHEMBL22753514 | 0.86 | ALDH1A1 (0.46) | ALDH1A1TSHRMAPK1SMN1; SMN2ADORA2A | |
| SCHEMBL331903 | 0.83 | PDE4A (0.47) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL23020227 | 0.75 | GSK3A (0.50) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL21974369 | 0.75 | GSK3A (0.50) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL13108310 | 0.75 | PDE4A (0.48) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL23509686 | 0.75 | RGS4 (0.44) | ALDH1A1TSHRSMN1; SMN2ADORA2BLMNA | |
| SCHEMBL24031478 | 0.73 | RGS4 (0.54) | ADORA2AADORA2BPDE4APDE4BPDE4C | |
| SCHEMBL30976977 | 0.73 | CSNK2A1 (0.38) | ALDH1A1TSHRSMN1; SMN2ADORA2AADORA2B |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020202777-A1 | EPOXY CURING COMPOUND AND EPOXY RESIN COMPOSITION | 堺化学工業株式会社 | 2020-10-08 | — | — | WO | disclosed |
| WO-2019034866-A1 | BICYCLIC PEPTIDE LIGAND STING CONJUGATES AND USES THEREOF | Bicyclerd Limited (GB) | 2019-02-21 | — | — | WO | disclosed |
| US-20130079485-A1 | SULFUR-CONTAINING POLYUREAS AND METHODS OF USE | PRC-DESOTO INTERNATIONAL, INC. (US) | 2013-03-28 | — | — | US | disclosed |