Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.50 |
| ▸ | HTR6 | P50406 | 1/20 | 0.50 |
| ▸ | INSR | P06213 | 1/20 | 0.36 |
| ▸ | IGF1R | P08069 | 1/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | APP | P05067 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | CA7 | P43166 | 1/20 | 0.34 |
| ▸ | CA9 | Q16790 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL15684021 | 0.85 | ALDH1A1 (0.42) | HTR2CHTR6INSRIGF1RCA1 | |
| SCHEMBL16665840 | 0.84 | CYP2A6 (0.38) | HTR2CHTR6INSRIGF1RCA1 | |
| SCHEMBL7065103 | 0.83 | CA1 (0.46) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL31390245 | 0.83 | CA1 (0.46) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL1477260 | 0.83 | CA1 (0.46) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL7120997 | 0.83 | APP (0.39) | HTR2CHTR6APPL3MBTL1CYP1A2 | |
| SCHEMBL12463684 | 0.82 | CYP1A2 (0.46) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL23264547 | 0.81 | ALDH1A1 (0.50) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL23264340 | 0.81 | ALDH1A1 (0.50) | INSRIGF1RCA1CA2L3MBTL1 | |
| SCHEMBL13720810 | 0.81 | ALDH1A1 (0.50) | INSRIGF1RCA1CA2L3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1937616-B1 | NEW BINAPHTHALENE DERIVATIVES, PREPARATION METHOD THEREOF AND ORGANIC ELECTRONIC DEVICE USING THE SAME | LG CHEMICAL LTD (KR) | 2014-12-17 | — | — | EP | disclosed |