Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | VDR | P11473 | 1/20 | 0.36 |
| ▸ | RXRA | P19793 | 2/20 | 0.36 |
| ▸ | RXRB | P28702 | 2/20 | 0.36 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.36 |
| ▸ | CNR2 | P34972 | 2/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | TNKS | O95271 | 4/20 | 0.35 |
| ▸ | TNKS2 | Q9H2K2 | 4/20 | 0.35 |
| ▸ | ESR1 | P03372 | 4/20 | 0.34 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.34 |
| ▸ | HSD17B1 | P14061 | 2/20 | 0.34 |
| ▸ | AR | P10275 | 1/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | PLK4 | O00444 | 1/20 | 0.34 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.34 |
| ▸ | AURKA | O14965 | 1/20 | 0.34 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | JAK2 | O60674 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL18899605 | 0.75 | ESR1 (0.46) | VDRTNKSTNKS2ESR1ESR2 | |
| SCHEMBL21449928 | 0.75 | CYP2D6 (0.41) | VDRRXRARXRBESR1ESR2 | |
| SCHEMBL13957373 | 0.75 | VDR (0.56) | VDRESR1ESR2ARTAAR1 | |
| SCHEMBL547767 | 0.72 | KIF11 (0.44) | TNKSTNKS2ESR1ESR2AR | |
| SCHEMBL18802754 | 0.72 | KIF11 (0.44) | TNKSTNKS2ESR1ESR2AR | |
| SCHEMBL10304793 | 0.71 | KIF11 (0.48) | RXRARXRBRXRG | |
| SCHEMBL14606540 | 0.71 | KLF10 (0.57) | ALOX5ESR1ESR2AR | |
| SCHEMBL13580639 | 0.71 | RXRB (0.55) | RXRARXRBRXRG | |
| SCHEMBL12849193 | 0.70 | PPARG (0.44) | VDRKIFC1KCNH2TAAR1 | |
| SCHEMBL9630722 | 0.70 | HSD17B1 (0.42) | ESR1ESR2HSD17B1TAAR1 |
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-2012158784-A2 | MODULATORS OF THE NUCLEAR HORMONE RECEPTOR ROR | KAMENECKA THEODORE MARK (US) | 2012-11-22 | — | — | WO | disclosed |