Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.53 |
| ▸ | CA9 | Q16790 | 1/20 | 0.53 |
| ▸ | NPC1 | O15118 | 4/20 | 0.48 |
| ▸ | RAB9A | P51151 | 3/20 | 0.48 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.42 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | DHFR | P00374 | 2/20 | 0.38 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.38 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.38 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.38 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL29683444 | 0.90 | CA12 (0.55) | CA12CA9NPC1RAB9AALOX5AP | |
| SCHEMBL20393716 | 0.78 | NPC1 (0.52) | CA12CA9NPC1RAB9AALOX5AP | |
| SCHEMBL19299831 | 0.77 | KDM4E (0.42) | NPC1RAB9AKDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL12354513 | 0.73 | CA12 (0.66) | CA12CA9NPC1RAB9AALOX5AP | |
| SCHEMBL29497601 | 0.73 | CA12 (0.56) | CA12CA9NPC1RAB9AALOX5AP | |
| SCHEMBL172248 | 0.72 | CYP19A1 (0.61) | CA12CA9NPC1RAB9AKDM4E | |
| SCHEMBL17553649 | 0.72 | NPC1 (0.39) | CA12CA9NPC1RAB9AALOX5AP | |
| SCHEMBL18819419 | 0.72 | NPC1 (0.32) | NPC1RAB9ATP53MAPTCASP1 | |
| SCHEMBL18819849 | 0.71 | ACSS2 (0.37) | CA12CA9NPC1RAB9APTGS2 | |
| SCHEMBL19299914 | 0.71 | — | — |
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-109996799-B | Fused bicyclic heterocyclic derivatives as pest control agents | 拜耳作物科学股份公司 | 2022-07-19 | — | — | CN | disclosed |