Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 3/20 | 0.42 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | FEN1 | P39748 | 3/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.38 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.38 |
| ▸ | ALOX5AP | P20292 | 2/20 | 0.38 |
| ▸ | PTPN5 | P54829 | 2/20 | 0.37 |
| ▸ | PTPN2 | P17706 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.37 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.37 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | PTGDR | Q13258 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 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 | |
|---|---|---|---|---|
| SCHEMBL10407361 | 0.91 | ESR1 (0.48) | DYRK1AESR1ESR2FEN1NUDT1 | |
| SCHEMBL10438722 | 0.90 | DYRK1A (0.54) | DYRK1AESR1ESR2FEN1NUDT1 | |
| SCHEMBL21817076 | 0.82 | HSD17B1 (0.45) | ESR1ESR2FEN1ALOX5APPTGDR2 | |
| SCHEMBL29402603 | 0.82 | HSD17B1 (0.45) | ESR1ESR2FEN1ALOX5APPTGDR2 | |
| SCHEMBL17699117 | 0.80 | CHRNB2 (0.55) | DYRK1AESR1ESR2NUDT1BACE1 | |
| SCHEMBL69755 | 0.79 | NUDT1 (0.57) | DYRK1AESR1ESR2NUDT1BACE1 | |
| SCHEMBL28101898 | 0.78 | PTGDR2 (0.45) | ESR1ESR2FEN1ALOX5APPTGDR2 | |
| SCHEMBL28931577 | 0.76 | ESR1 (0.44) | ESR1ESR2NUDT1BACE1HSP90AA1 | |
| Bromide SCHEMBL28390505 | 0.76 | PTGS2 (0.44) | FEN1HSP90AA1ALOX5APPTPN5PTPN2 | |
| SCHEMBL10899805 | 0.76 | NUDT1 (0.54) | DYRK1AESR1ESR2NUDT1BACE1 |
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-1993014140-A1 | EPOXIDATION PRODUCTS OF 1,3,5-TRIS(4'-HYDROXYPHENYL)BENZENES____ | HOECHST CELANESE CORPORATION (US) | 1993-07-22 | — | — | WO | disclosed |