Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
| ▸ | HTT | P42858 | 1/20 | 0.30 |
| ▸ | MAP3K5 | Q99683 | 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 | |
|---|---|---|---|---|
| SCHEMBL16592100 | 0.69 | VNN1 (0.38) | CYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL20839396 | 0.68 | CRHR1 (0.34) | AR | |
| SCHEMBL29855995 | 0.68 | CRHR1 (0.34) | AR | |
| SCHEMBL21828955 | 0.68 | TRPV4 (0.37) | CYP3A4MAPK1TDP1 | |
| SCHEMBL10084152 | 0.66 | CYP11B1 (0.35) | CYP3A4MAPK1 | |
| SCHEMBL27685486 | 0.66 | CYP1A2 (0.38) | — | |
| SCHEMBL26296821 | 0.65 | AR (0.42) | ARCYP3A4TSHRMAPK1TDP1 | |
| SCHEMBL28761541 | 0.64 | KDM4E (0.35) | — | |
| SCHEMBL28761540 | 0.64 | KCNA5 (0.46) | ARHCAR3HTTMAP3K5 | |
| SCHEMBL4723984 | 0.64 | MAPT (0.41) | ARHCAR3HTTMAP3K5 |
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-111372455-B | Herbicidally active pyridyl-/pyrimidinyl-pyrimidine derivatives | 先正达参股股份有限公司 | 2022-10-11 | — | — | CN | disclosed |
| CN-111372455-A | Herbicidally active pyridyl-/pyrimidinyl-pyrimidine derivatives | 先正达参股股份有限公司 | 2020-07-03 | — | — | CN | disclosed |