Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCB1 | P08183 | 4/20 | 0.56 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | BCHE | P06276 | 4/20 | 0.44 |
| ▸ | HTR1A | P08908 | 3/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 3/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | CA12 | O43570 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | CRHBP | P24387 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL4101732 | 0.80 | ABCB1 (0.56) | ABCB1ABCG2SMN1; SMN2BCHEHTR1A | |
| SCHEMBL7532608 | 0.80 | BCHE (0.58) | BCHEHTR1AADRA1DADRA1AADRA1B | |
| SCHEMBL42242 | 0.80 | SMN1; SMN2 (0.50) | ABCB1SMN1; SMN2KDM4ECA12CA1 | |
| SCHEMBL10980213 | 0.79 | SMN1; SMN2 (0.52) | SMN1; SMN2KDM4EL3MBTL1CA12CA1 | |
| SCHEMBL6270354 | 0.78 | ABCB1 (0.57) | ABCB1ABCG2SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL4369269 | 0.78 | ABCB1 (0.57) | ABCB1ABCG2SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL7567008 | 0.77 | SMN1; SMN2 (0.50) | ABCB1ABCG2SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL1547806 | 0.74 | SMN1; SMN2 (0.50) | ABCB1ABCG2SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL3306584 | 0.74 | SMN1; SMN2 (0.54) | ABCB1ABCG2SMN1; SMN2KDM4EL3MBTL1 | |
| SCHEMBL9235134 | 0.74 | ABCB1 (0.50) | ABCB1ABCG2SMN1; SMN2HTR1AADRA1D |
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-1896419-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2008-03-12 | — | — | EP | disclosed |
| WO-2006129978-A1 | 3,4-DIHYDROISOQUINOLINIUM SALT DERIVATIVES | HANWHA CHEMICAL CORPORATION (KR) | 2006-12-07 | — | — | WO | disclosed |