Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | UNG | P13051 | 1/20 | 0.32 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.31 |
| ▸ | CDK1 | P06493 | 1/20 | 0.31 |
| ▸ | CDK4 | P11802 | 1/20 | 0.31 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.31 |
| ▸ | CCND1 | P24385 | 1/20 | 0.31 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | ERN1 | O75460 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.30 |
| ▸ | CA5A | P35218 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.30 |
| ▸ | CA5B | Q9Y2D0 | 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 | |
|---|---|---|---|---|
| SCHEMBL10818532 | 0.82 | — | — | |
| Acetaldehyde SCHEMBL4586938 | 0.81 | TSHR (0.32) | ALDH1A1 | |
| Formaldehyde SCHEMBL28456729 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL9772662 | 0.78 | — | — | |
| Ammonia Solution, Strong SCHEMBL10391161 | 0.78 | — | — | |
| SCHEMBL29644943 | 0.78 | NR1H2 (0.34) | ALDH1A1CA12CA2LMNACYP3A4 | |
| Water SCHEMBL11252857 | 0.78 | — | — | |
| SCHEMBL960763 | 0.77 | CA12 (0.33) | ALDH1A1CA12CA2LMNACYP3A4 | |
| Ethyne SCHEMBL11592039 | 0.76 | — | — | |
| SCHEMBL9494432 | 0.74 | ALOX15 (0.35) | — |
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-110467677-B | Broad-spectrum recognition single-chain antibody of pyrethroid pesticide metabolite and application thereof | 江苏省农业科学院 | 2022-08-30 | — | — | CN | disclosed |