Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | AR | P10275 | 5/20 | 0.33 |
| ▸ | AKR1C3 | P42330 | 3/20 | 0.32 |
| ▸ | AKR1C2 | P52895 | 3/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | PARP1 | P09874 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.30 |
| ▸ | PLK1 | P53350 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28944972 | 1.00 | CYP3A4 (0.34) | CYP3A4SMN1; SMN2ARAKR1C3AKR1C2 | |
| SCHEMBL22926161 | 0.84 | DAO (0.37) | SMN1; SMN2AKR1C3AKR1C2TSHRHPGD | |
| SCHEMBL29639664 | 0.84 | DAO (0.37) | SMN1; SMN2AKR1C3AKR1C2TSHRHPGD | |
| SCHEMBL29728972 | 0.76 | PARP10 (0.37) | SMN1; SMN2TSHRPARP1ALOX15 | |
| SCHEMBL12128208 | 0.74 | PARP1 (0.47) | CYP3A4SMN1; SMN2ARTSHRPARP1 | |
| SCHEMBL31572408 | 0.74 | PARP1 (0.47) | CYP3A4SMN1; SMN2TSHRPARP1 | |
| SCHEMBL11298266 | 0.72 | CES2 (0.46) | — | |
| SCHEMBL23977176 | 0.70 | TSHR (0.39) | SMN1; SMN2TSHR | |
| SCHEMBL14431596 | 0.70 | CES2 (0.52) | CYP3A4SMN1; SMN2 | |
| SCHEMBL24156405 | 0.68 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118561817-A | Novel heteroaryl-triazole compounds as pesticides | 拜耳公司 | 2024-08-30 | — | — | CN | disclosed |
| CN-118496198-A | Novel heteroaryl-triazole compounds as pesticides | 拜耳公司 | 2024-08-16 | — | — | CN | disclosed |
| EP-4065577-A1 | NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES | Bayer Aktiengesellschaft (DE) | 2022-10-05 | — | — | EP | disclosed |
| CN-114761402-A | Novel heteroaryl-triazole compounds as pesticides | 拜耳公司 | 2022-07-15 | — | — | CN | disclosed |
| EP-4003974-A1 | NOVEL HETEROARYL-TRIAZOLE COMPOUNDS AS PESTICIDES | Bayer Aktiengesellschaft (DE) | 2022-06-01 | — | — | EP | disclosed |
| CN-114502545-A | Novel heteroaryl-triazole compounds as pesticides | 拜耳公司 | 2022-05-13 | — | — | CN | disclosed |