Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM5A | P29375 | 4/20 | 0.47 |
| ▸ | CA1 | P00915 | 3/20 | 0.46 |
| ▸ | CA12 | O43570 | 2/20 | 0.46 |
| ▸ | CA9 | Q16790 | 2/20 | 0.46 |
| ▸ | PHF8 | Q9UPP1 | 2/20 | 0.44 |
| ▸ | KDM4C | Q9H3R0 | 2/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | DRD3 | P35462 | 1/20 | 0.41 |
| ▸ | SCN1A | P35498 | 1/20 | 0.41 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.41 |
| ▸ | SCN3A | Q9NY46 | 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 | |
|---|---|---|---|---|
| SCHEMBL28016794 | 0.91 | KDM5A (0.50) | KDM5ACA1PHF8KDM4CCA2 | |
| Acetic Acid Methyl Ester SCHEMBL23398350 | 0.86 | ALDH1A1 (0.48) | KDM5ACA1CA12CA9PHF8 | |
| SCHEMBL28407454 | 0.86 | KDM5A (0.56) | KDM5ACA1CA12CA9PHF8 | |
| Hexane SCHEMBL11722687 | 0.82 | EPHX1 (0.52) | CA1CA2LMNAZDHHC7EPHX1 | |
| Pentane SCHEMBL29061324 | 0.82 | CA1 (0.50) | CA1CA2LMNAZDHHC7EPHX1 | |
| SCHEMBL8394792 | 0.80 | MEN1 (0.52) | KDM5ACA1CA12CA9PHF8 | |
| SCHEMBL65040 | 0.80 | MEN1 (0.52) | KDM5ACA1CA12CA9PHF8 | |
| SCHEMBL23223422 | 0.80 | CYP2D6 (0.45) | KDM5AKDM4CLMNACYP1A2CHRM2 | |
| Heptane SCHEMBL28605847 | 0.79 | EPHX1 (0.56) | CA1CA2LMNAZDHHC7EPHX1 | |
| Bicarbonate SCHEMBL5874864 | 0.79 | CA12 (0.54) | KDM5ACA1CA12CA9PHF8 |
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-107004912-A | Electrolyte and metal hydride battery | 巴斯夫公司 | 2017-08-01 | — | — | CN | disclosed |