Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GCGR | P47871 | 11/20 | 0.48 |
| ▸ | HTT | P42858 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.40 |
| ▸ | DHPS | P49366 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.39 |
| ▸ | KCNH3 | Q9ULD8 | 1/20 | 0.38 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.37 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL10606383 | 0.98 | GCGR (0.49) | GCGRHTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9850104 | 0.84 | ALDH1A1 (0.54) | NPC1RAB9ASMN1; SMN2MAPTPTGS2 | |
| SCHEMBL29116869 | 0.81 | GCGR (0.51) | GCGRHTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10555514 | 0.80 | GCGR (0.52) | GCGRHTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL10559262 | 0.79 | RARB (0.54) | GCGRRAB9ASMN1; SMN2MAPT | |
| SCHEMBL28827858 | 0.79 | RAB9A (0.46) | GCGRHTTNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL9815158 | 0.77 | MGLL (0.44) | GCGRNPC1RAB9ASMN1; SMN2MAPT | |
| SCHEMBL9694782 | 0.76 | MAPT (0.50) | NPC1RAB9ASMN1; SMN2MAPTTLR8 | |
| SCHEMBL12888460 | 0.76 | PTGS2 (0.51) | HTTNPC1RAB9ASMN1; SMN2PTGS2 | |
| SCHEMBL12495729 | 0.75 | ADORA2A (0.46) | GCGRNPC1RAB9AMAPTNPSR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116969896-B | Preparation method and application of pyrimidine liquid crystal compound | 山东千铄新材料有限公司 | 2023-12-08 | — | — | CN | disclosed |
| CN-116969896-A | Preparation method and application of pyrimidine liquid crystal compound | 山东千铄新材料有限公司 | 2023-10-31 | — | — | CN | disclosed |