Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.45 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.42 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.42 |
| ▸ | PDE4B | Q07343 | 4/20 | 0.40 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 2/20 | 0.40 |
| ▸ | PDE3A | Q14432 | 2/20 | 0.40 |
| ▸ | PDE7A | Q13946 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | PIM1 | P11309 | 1/20 | 0.36 |
| ▸ | FLT3 | P36888 | 1/20 | 0.36 |
| ▸ | CSNK2B | P67870 | 1/20 | 0.36 |
| ▸ | CSNK2A1 | P68400 | 1/20 | 0.36 |
| ▸ | PIM2 | Q9P1W9 | 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 | |
|---|---|---|---|---|
| SCHEMBL29549332 | 0.81 | ADORA2A (0.43) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL22828480 | 0.81 | ADORA2A (0.43) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL19867175 | 0.80 | PDE4A (0.46) | HTTPDE4BPDE4APDE4CPDE4D | |
| SCHEMBL19867182 | 0.79 | ALK (0.46) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL25637824 | 0.79 | PTK2 (0.54) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL3950993 | 0.77 | KMT2A (0.39) | ALDH1A1SMN1; SMN2MAPTKDM4EMEN1 | |
| SCHEMBL1284289 | 0.77 | PDE4B (0.58) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL24379260 | 0.75 | ALK (0.41) | ADORA2AADORA1PDE4BPDE4APDE4C | |
| SCHEMBL18194338 | 0.74 | KHK (0.36) | SMN1; SMN2MAPTMEN1NPC1TSHR | |
| SCHEMBL24174509 | 0.74 | HTT (0.61) | HTTADORA2AADORA1PDE4BPDE4A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3498716-A1 | THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS | Hongyun Biotech Co., Ltd. (CN) | 2019-06-19 | — | — | EP | disclosed |
| WO-2018028721-A1 | THIENOPYRIMIDINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION, AND APPLICATIONS | 厦门大学 | 2018-02-15 | — | — | WO | disclosed |