Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | HSD17B3 | P37058 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | ALDH1A2 | O94788 | 2/20 | 0.33 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.33 |
| ▸ | ALDH1B1 | P30837 | 2/20 | 0.33 |
| ▸ | ALDH1A3 | P47895 | 2/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.33 |
| ▸ | TYMP | P19971 | 1/20 | 0.32 |
| ▸ | ELANE | P08246 | 2/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | NOS2 | P35228 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 3/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | PRKCI | P41743 | 1/20 | 0.30 |
| ▸ | CTRC | Q99895 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL4054834 | 0.83 | SRC (0.39) | KDM4EMAPK1HCAR2TYMPCTRC | |
| SCHEMBL12188715 | 0.77 | KDM4E (0.39) | KDM4EMAPK1ELANECTRC | |
| SCHEMBL10425151 | 0.73 | ELANE (0.39) | KDM4EHSD17B3ALDH1A1ELANERAB9A | |
| SCHEMBL1711830 | 0.70 | KDM4E (0.39) | KDM4EALDH1A1TYMPELANECA12 | |
| SCHEMBL9768922 | 0.70 | — | — | |
| SCHEMBL11447658 | 0.70 | LPL (0.31) | — | |
| SCHEMBL28288308 | 0.70 | — | — | |
| SCHEMBL2969768 | 0.68 | — | — | |
| SCHEMBL12462036 | 0.68 | — | — | |
| SCHEMBL9768919 | 0.68 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080138866-A1 | Process for the Preparation of (R)-4,4-Dialkoxy-Pyran-3-Ols Such as (R)-4,4-Dimethoxy-Pyran-3-Ol | MERCK SHARP & DOHME CORP. | 2008-06-12 | — | — | US | disclosed |
| EP-1861386-A1 | PROCESS FOR THE PREPARATION OF (R)-4,4-DIALKOXY-PYRAN-3-OLS SUCH AS (R)-4,4-DIMETHOXY-PYRAN-3-OL | Merck & Co., Inc. (US) | 2007-12-05 | — | — | EP | disclosed |
| WO-2006098959-A1 | PROCESS FOR THE PREPARATION OF (R)-4,4-DIALKOXY-PYRAN-3-OLS SUCH AS (R)-4,4-DIMETHOXY-PYRAN-3-OL | MERCK & CO., INC. (US) | 2006-09-21 | — | — | WO | disclosed |