Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 1/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 1/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | GPR3 | P46089 | 1/20 | 0.35 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.34 |
| ▸ | CYSLTR2 | Q9NS75 | 7/20 | 0.34 |
| ▸ | CYSLTR1 | Q9Y271 | 7/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | CTSG | P08311 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL16397979 | 1.00 | NR1H2 (0.38) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL5087071 | 1.00 | NR1H2 (0.38) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL5084518 | 1.00 | NR1H2 (0.38) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL4652057 | 1.00 | NR1H2 (0.38) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL5086942 | 0.99 | NR1H2 (0.36) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL5080844 | 0.89 | PNMT (0.31) | SIGMAR1 | |
| SCHEMBL8018567 | 0.80 | NR1H2 (0.37) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL6571186 | 0.80 | NR1H2 (0.37) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL8024446 | 0.80 | NR1H2 (0.37) | NR1H2NR1H3LIPGALDH1A1CYP1A2 | |
| SCHEMBL6573515 | 0.80 | NR1H2 (0.37) | NR1H2NR1H3LIPGALDH1A1CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1960442-A1 | HALOGEN SUBSTITUTED HETEROATOM-CONTAINING METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | ExxonMobil Chemical Patents Inc. (US) | 2008-08-27 | — | — | EP | disclosed |
| WO-2007070046-A1 | HALOGEN SUBSTITUTED HETEROATOM-CONTAINING METALLOCENE COMPOUNDS FOR OLEFIN POLYMERIZATION | EXXONMOBIL CHEMICAL PATENTS INC. (US) | 2007-06-21 | — | — | WO | disclosed |