Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 2/20 | 0.40 |
| ▸ | MMP3 | P08254 | 1/20 | 0.40 |
| ▸ | CYP11B2 | P19099 | 2/20 | 0.39 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.39 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.39 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.39 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.39 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.39 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | ESR1 | P03372 | 1/20 | 0.38 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL18751765 | 0.95 | MEN1 (0.45) | HRH3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL15434379 | 0.95 | MEN1 (0.45) | HRH3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL23204413 | 0.93 | HRH3 (0.50) | HRH3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL23204705 | 0.93 | HRH3 (0.50) | HRH3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL12048461 | 0.93 | HRH3 (0.44) | HRH3MEN1NPC1RAB9AKMT2A | |
| SCHEMBL23204378 | 0.92 | CYP11B1 (0.49) | HRH3CA1CA2CYP11B2PGR | |
| SCHEMBL23204954 | 0.92 | CYP11B1 (0.49) | HRH3CA1CA2CYP11B2PGR | |
| SCHEMBL23204720 | 0.92 | CYP11B1 (0.49) | HRH3CA1CA2CYP11B2PGR | |
| SCHEMBL23204439 | 0.92 | CYP11B1 (0.49) | HRH3CA1CA2CYP11B2PGR | |
| SCHEMBL23204399 | 0.90 | CA1 (0.37) | HRH3MEN1NPC1RAB9AKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021066319-A2 | TERTIARY AMINE DERIVATIVE AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | 주식회사 랩토 | 2021-04-08 | — | — | WO | disclosed |