Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.56 |
| ▸ | ESR1 | P03372 | 4/20 | 0.54 |
| ▸ | ESR2 | Q92731 | 4/20 | 0.54 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | TYR | P14679 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | KLF10 | Q13118 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL9068821 | 0.98 | CYP2D6 (0.54) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL9500740 | 0.98 | CYP2D6 (0.54) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL673962 | 0.95 | CYP2D6 (0.57) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL7160007 | 0.90 | KLF10 (0.61) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL14956383 | 0.88 | KLF10 (0.59) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL5165521 | 0.87 | CYP2D6 (0.61) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL21002165 | 0.85 | CYP2D6 (0.67) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL11800133 | 0.85 | TYR (0.65) | CYP2D6ALOX15TDP1ALDH1A1HPGD | |
| SCHEMBL5082027 | 0.84 | KLF10 (0.62) | CYP2D6ESR1ESR2ALOX15TDP1 | |
| SCHEMBL31621158 | 0.84 | KLF10 (0.62) | CYP2D6ESR1ESR2ALOX15TDP1 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9795549-B2 | 1,2-alkane polyol-containing composition | OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) | 2017-10-24 | — | — | US | disclosed |
| US-20160045414-A1 | 1,2-ALKANE POLYOL-CONTAINING COMPOSITION | OSAKA ORGANIC CHEMICAL INDUSTRY LTD. (JP) | 2016-02-18 | — | — | US | disclosed |
| EP-2985017-A1 | 1,2-ALKANE POLYOL-CONTAINING COMPOSITION | Osaka Organic Chemical Ind., Ltd. (JP) | 2016-02-17 | — | — | EP | disclosed |
| US-4714691-A | Heterogeneous catalyst process | ETHYL CORPORATION (US) | 1987-12-22 | — | — | US | disclosed |
| US-4631349-A | RESIN-BONDED ALUMINUM PHENOXIDE CATALYST TO ALKYLATE PHENOLS | ETHYL CORPORATION (US) | 1986-12-23 | — | — | US | disclosed |
| US-4245099-A | ANTIINFLAMMATORY, ANALGESIC, DIURETIC, ANTIPYRETIC AND HYPOTENSIVE AGENTS | ONO PHARMACEUTICAL CO., LTD. (JP) | 1981-01-13 | — | — | US | disclosed |