Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA9 | Q16790 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.37 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | EDNRB | P24530 | 1/20 | 0.36 |
| ▸ | EDNRA | P25101 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.36 |
| ▸ | AKR1B1 | P15121 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29220658 | 0.78 | TTR (0.36) | TNKS2CYP1A2MAPK1CYP19A1MAPT | |
| SCHEMBL10716838 | 0.74 | MAOA (0.52) | CA1CA2CA7CA9MAPK1 | |
| SCHEMBL9811069 | 0.73 | PPIA (0.43) | TNKS2PDK2CYP19A1PPIASMARCA2 | |
| SCHEMBL29285411 | 0.72 | MAPK1 (0.44) | CYP1A2MAPK1CYP19A1MAPTALDH1A1 | |
| SCHEMBL2072999 | 0.72 | MAPT (0.52) | CA1CA2CA7CA9MAPK1 | |
| SCHEMBL760904 | 0.72 | ADORA2A (0.57) | CA1CA2CA7CA9MAPK1 | |
| SCHEMBL29797969 | 0.71 | GPR3 (0.46) | CYP1A2CYP19A1MEN1KMT2AHTR2B | |
| SCHEMBL4359049 | 0.71 | GPR3 (0.46) | CYP1A2CYP19A1MEN1KMT2AHTR2B | |
| SCHEMBL31457 | 0.69 | EDNRB (0.40) | TNKS2CYP1A2MAPK1MAPTALDH1A1 | |
| SCHEMBL208466 | 0.69 | CA1 (0.44) | CA1CA2CA7CA9TNKS2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-108137527-B | Novel compound and organic light emitting diode comprising the same | 株式会社LG化学 | 2021-08-20 | — | — | CN | disclosed |