Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 6/20 | 0.42 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 8/20 | 0.40 |
| ▸ | APP | P05067 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 2/20 | 0.38 |
| ▸ | KDM1B | Q8NB78 | 1/20 | 0.38 |
| ▸ | RPS6KA3 | P51812 | 2/20 | 0.37 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.36 |
| ▸ | GAA | P10253 | 1/20 | 0.36 |
| ▸ | ABL1 | P00519 | 1/20 | 0.36 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.36 |
| ▸ | BCR | P11274 | 1/20 | 0.36 |
| ▸ | KIF11 | P52732 | 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 | |
|---|---|---|---|---|
| SCHEMBL1759436 | 0.85 | ESR2 (0.47) | ESR2HSD17B1ESR1APPCYP3A4 | |
| SCHEMBL20252191 | 0.81 | ESR2 (0.44) | ESR2CYP2C9CYP2C19KDM1AKDM1B | |
| SCHEMBL10190451 | 0.78 | ESR2 (0.56) | ESR2HSD17B1ESR1GAAABL1 | |
| SCHEMBL12700730 | 0.77 | CYP1A2 (0.40) | CYP2C9CYP2C19KDM1AKDM1B | |
| SCHEMBL29929314 | 0.76 | ESR2 (0.54) | ESR2HSD17B1ESR1GAAABL1 | |
| SCHEMBL27884914 | 0.75 | USP7 (0.43) | ESR2HSD17B1ESR1APPCYP3A4 | |
| SCHEMBL28204878 | 0.74 | ESR2 (0.52) | ESR2HSD17B1ESR1GAAABL1 | |
| SCHEMBL27928527 | 0.74 | ESR1 (0.57) | ESR2ESR1APPCYP3A4CYP2C9 | |
| SCHEMBL27927624 | 0.73 | ALOX15 (0.48) | ESR2HSD17B1ESR1GAAABL1 | |
| SCHEMBL17625680 | 0.72 | GAA (0.54) | ESR2HSD17B1ESR1CYP3A4CYP2C9 |
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-105392779-A | Tetrazolinone compound and use thereof | SUMITOMO CHEMICAL CO | 2016-03-09 | — | — | CN | disclosed |