Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.45 |
| ▸ | ADORA3 | P0DMS8 | 8/20 | 0.44 |
| ▸ | TACR3 | P29371 | 1/20 | 0.44 |
| ▸ | DHODH | Q02127 | 1/20 | 0.43 |
| ▸ | ATM | Q13315 | 1/20 | 0.42 |
| ▸ | PDE5A | O76074 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 3/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.42 |
| ▸ | DRD3 | P35462 | 2/20 | 0.42 |
| ▸ | MAOA | P21397 | 1/20 | 0.41 |
| ▸ | MAOB | P27338 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28438033 | 0.98 | POLB (0.51) | POLBTDP1L3MBTL1ADORA3TACR3 | |
| SCHEMBL29219450 | 0.97 | POLB (0.53) | POLBTDP1L3MBTL1ADORA3TACR3 | |
| SCHEMBL29219482 | 0.86 | POLB (0.49) | POLBTDP1L3MBTL1SMN1; SMN2MAOA | |
| SCHEMBL28842680 | 0.82 | ACHE (0.43) | POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28842781 | 0.81 | ACHE (0.43) | POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28842691 | 0.81 | ACHE (0.43) | POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28842660 | 0.81 | ACHE (0.43) | POLBNPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28603583 | 0.80 | POLB (0.53) | POLBTDP1L3MBTL1TACR3DHODH | |
| SCHEMBL25523590 | 0.80 | KDM4E (0.56) | POLBTDP1L3MBTL1TACR3LMNA | |
| SCHEMBL25833794 | 0.80 | BACE1 (0.47) | POLBDHODH |
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 |
|---|---|---|---|---|---|---|---|
| CN-117945995-A | Alkylated nitrogen-containing heterocyclic compound and preparation method and application thereof | 中国科学院青海盐湖研究所 | 2024-04-30 | — | — | CN | disclosed |