Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB2 | P07550 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | HPD | P32754 | 1/20 | 0.33 |
| ▸ | GRM8 | O00222 | 7/20 | 0.32 |
| ▸ | GRM4 | Q14833 | 7/20 | 0.32 |
| ▸ | GRM6 | O15303 | 3/20 | 0.32 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27748906 | 1.00 | ADRB2 (0.35) | ADRB2HTTHPDGRM8GRM4 | |
| Cadaverine Tartrate SCHEMBL27748849 | 0.94 | GRM8 (0.35) | ADRB2GRM8GRM4GRM6FFAR1 | |
| SCHEMBL1185442 | 0.85 | ADRB2 (0.38) | ADRB2HTTHPDGRM8GRM4 | |
| SCHEMBL2582039 | 0.85 | ADRB2 (0.38) | ADRB2HTTHPDGRM8GRM4 | |
| Hydrochloric Acid SCHEMBL1185967 | 0.84 | ADRB2 (0.40) | ADRB2HTTHPDGRM8GRM4 | |
| SCHEMBL27748907 | 0.80 | ADRB2 (0.37) | ADRB2HTTHPDGRM8GRM4 | |
| SCHEMBL27748853 | 0.80 | ADRB2 (0.37) | ADRB2HTTHPDGRM8GRM4 | |
| SCHEMBL27716643 | 0.79 | CES2 (0.37) | ALDH1A1CES2MAPTGAAMAPK1 | |
| SCHEMBL27696887 | 0.78 | HPGD (0.47) | ALDH1A1HPGDMAPTLMNAMAPK1 | |
| SCHEMBL12980888 | 0.76 | ADRB2 (0.37) | ADRB2HTTHPDGRM8GRM4 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101495463-B | Seven-membered ring compound, production method thereof and pharmaceutical use thereof | DAIICHI SANKYO CO LTD | 2012-08-15 | — | — | CN | disclosed |
| CN-101495463-A | Seven-membered ring compound, production method thereof and pharmaceutical use thereof | ASUBIO PHARMA CO LTD (JP) | 2009-07-29 | — | — | CN | disclosed |