Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR3 | P46089 | 2/20 | 0.41 |
| ▸ | PDE2A | O00408 | 3/20 | 0.39 |
| ▸ | PDE10A | Q9Y233 | 2/20 | 0.39 |
| ▸ | MAT2A | P31153 | 7/20 | 0.37 |
| ▸ | GPBAR1 | Q8TDU6 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.34 |
| ▸ | CES2 | O00748 | 1/20 | 0.33 |
| ▸ | EPAS1 | Q99814 | 1/20 | 0.33 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.33 |
| ▸ | MPL | P40238 | 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 | |
|---|---|---|---|---|
| SCHEMBL2049535 | 0.87 | HSD11B1 (0.35) | GPR3PDE2APDE10AMAT2AGPBAR1 | |
| SCHEMBL14732011 | 0.83 | NPC1 (0.31) | — | |
| SCHEMBL5778162 | 0.83 | HSD11B1 (0.38) | GPR3ALDH1A1TSHRHSD11B1 | |
| SCHEMBL2052904 | 0.81 | MPL (0.35) | PDE2APDE10AGPBAR1MPL | |
| SCHEMBL8416356 | 0.81 | HSD11B1 (0.42) | GPR3PDE2APDE10AMAT2AHSD11B1 | |
| SCHEMBL2053354 | 0.81 | MPL (0.35) | GPR3PDE2AGPBAR1ALDH1A1HSD11B1 | |
| SCHEMBL2053324 | 0.81 | CES2 (0.38) | PDE2AMAT2AALDH1A1TSHRCES2 | |
| SCHEMBL5323119 | 0.79 | CYP1A1 (0.39) | GPR3CES2 | |
| SCHEMBL432357 | 0.79 | GABRP (0.41) | GPR3PDE2APDE10AHSD11B1 | |
| SCHEMBL434431 | 0.78 | L3MBTL1 (0.38) | GPR3ALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2013182433-A1 | A PROCESS USING GRIGNARD REAGENTS | BASF SE (DE) | 2013-12-12 | — | — | WO | disclosed |
| EP-2547687-A1 | A PROCESS USING GRIGNARD REAGENTS | BASF SE (DE) | 2013-01-23 | — | — | EP | disclosed |
| EP-2513067-A1 | METHOD FOR PRODUCING TRIAZOLINTHIONE DERIVATIVES AND INTERMEDIATES THEREOF | BASF SE (DE) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011113820-A1 | A PROCESS USING GRIGNARD REAGENTS | BASF SE (DE) | 2011-09-22 | — | — | WO | disclosed |