Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.42 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | PTPN7 | P35236 | 1/20 | 0.36 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.36 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.34 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.34 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.34 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11339054 | 0.79 | KDM4E (0.46) | CYP1A2CYP2A6TAAR1MAPK1PTPN7 | |
| SCHEMBL7534755 | 0.79 | MAPK14 (0.43) | CYP1A2CYP2A6TAAR1MEN1KMT2A | |
| SCHEMBL11235154 | 0.79 | TAAR1 (0.46) | CYP1A2CYP2A6TAAR1MAPK1ALDH1A1 | |
| SCHEMBL11321654 | 0.79 | CYP1A2 (0.40) | CYP1A2CYP2A6TAAR1MAPK1PTPN7 | |
| SCHEMBL16119348 | 0.77 | KDM4E (0.40) | CYP1A2CYP2A6TAAR1MAPK1PTPN7 | |
| Bromide SCHEMBL11730094 | 0.77 | CYP1A2 (0.39) | CYP1A2CYP2A6TAAR1MAPK1PTPN7 | |
| SCHEMBL11242607 | 0.77 | CYP1A2 (0.48) | CYP1A2CYP2A6TAAR1MEN1KMT2A | |
| SCHEMBL11505439 | 0.74 | MAPT (0.47) | CYP1A2ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL10987577 | 0.74 | MAPT (0.41) | CYP1A2CYP2A6MAPK1ALDH1A1MAPT | |
| SCHEMBL7350648 | 0.73 | CYP1A2 (0.43) | CYP1A2CYP2A6ALDH1A1MAPTL3MBTL1 |
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 |
|---|---|---|---|---|---|---|---|
| US-4356322-A | ADRENERGIC STIMULANTS; CARDIOTONIC AGENTS | VEB ARZNEIMITTELWERK DRESDEN (DD) | 1982-10-26 | — | — | US | disclosed |