Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | UGT2B7 | P16662 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 8/20 | 0.43 |
| ▸ | ESR2 | Q92731 | 8/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | PDCD1 | Q15116 | 1/20 | 0.43 |
| ▸ | CD274 | Q9NZQ7 | 1/20 | 0.43 |
| ▸ | ABL1 | P00519 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 2/20 | 0.41 |
| ▸ | BCR | P11274 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.39 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL20398782 | 0.83 | CYP1A2 (0.50) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL487450 | 0.83 | CYP1A2 (0.56) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL15853505 | 0.81 | UGT2B7 (0.67) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL9118979 | 0.81 | UGT2B7 (0.67) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL13586940 | 0.79 | CYP1A2 (0.46) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL13706061 | 0.79 | CYP1A2 (0.46) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL18772356 | 0.79 | CYP2C9 (0.53) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL13557419 | 0.78 | UGT2B7 (0.63) | CYP1A2UGT2B7TSHRHIF1ATDP1 | |
| SCHEMBL12356631 | 0.78 | ESR1 (0.50) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 | |
| SCHEMBL27323386 | 0.77 | HSD17B10 (0.44) | CYP1A2HSD17B10CYP2C9UGT2B7ESR1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024112123-A1 | NOVEL COMPOUND AS SELECTIVE ESTROGEN RECEPTOR MODULATOR | 재단법인 대구경북첨단의료산업진흥재단 | 2024-05-30 | — | — | WO | disclosed |