Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.35 |
| ▸ | MGLL | Q99685 | 1/20 | 0.33 |
| ▸ | SPHK1 | Q9NYA1 | 1/20 | 0.32 |
| ▸ | CA12 | O43570 | 1/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
| ▸ | CA9 | Q16790 | 1/20 | 0.32 |
| ▸ | THRB | P10828 | 2/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | BLM | P54132 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | THRA | P10827 | 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 | |
|---|---|---|---|---|
| SCHEMBL6234457 | 0.93 | ALDH1A1 (0.31) | — | |
| SCHEMBL8898036 | 0.70 | USP2 (0.38) | EPHX1MGLLSPHK1CA12CA1 | |
| SCHEMBL6123115 | 0.70 | ALDH1A1 (0.48) | MGLLCA12CA1CA2CA9 | |
| SCHEMBL6598672 | 0.63 | EPHX1 (0.52) | EPHX1SPHK1THRBCES2GMNN | |
| SCHEMBL10886661 | 0.63 | EPHX1 (0.52) | EPHX1SPHK1THRBCES2GMNN | |
| SCHEMBL11292896 | 0.63 | CES2 (0.42) | EPHX1THRBCES2GMNNTP53 | |
| SCHEMBL14166676 | 0.63 | CES2 (0.46) | CES2HSD17B10 | |
| SCHEMBL23015007 | 0.62 | EPHX1 (0.55) | EPHX1SPHK1THRBCES2GMNN | |
| SCHEMBL2772887 | 0.62 | EPHX1 (0.55) | EPHX1SPHK1THRBCES2GMNN | |
| SCHEMBL11448367 | 0.62 | EPHX1 (0.55) | EPHX1SPHK1THRBCES2GMNN |
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-2005007786-A2 | DITHIOCARBAMATE AND BORATED DITHIOCARBAMATE COMPOSITIONS; AND LUBRICATING COMPOSITIONS CONTAINING SAME | R.T. VANDERBILT COMPANY, INC. (US) | 2005-01-27 | — | — | WO | disclosed |