Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.46 |
| ▸ | ADRA2A | P08913 | 5/20 | 0.44 |
| ▸ | ADRA2B | P18089 | 5/20 | 0.44 |
| ▸ | ADRA2C | P18825 | 5/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | ADRA1A | P35348 | 3/20 | 0.44 |
| ▸ | ADRA1B | P35368 | 3/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.44 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.44 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.44 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | HTR7 | P34969 | 1/20 | 0.43 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.39 |
| ▸ | SCN4A | P35499 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8427289 | 0.84 | ADRA2A (0.43) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL106514 | 0.83 | ADRA2A (0.42) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL8082747 | 0.81 | ESR1 (0.62) | ESR1ADRA2AADRA2BADRA2CTSHR | |
| SCHEMBL1053969 | 0.80 | TSHR (0.55) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL31611894 | 0.79 | ADRA2A (0.40) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL8750426 | 0.79 | ADRA2A (0.40) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL11004514 | 0.79 | ADRA2A (0.40) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL196657 | 0.78 | TSHR (0.50) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL9453500 | 0.78 | KDM4E (0.41) | ESR1ADRA2AADRA2BADRA2CCYP1A2 | |
| SCHEMBL111214 | 0.77 | ADRA2A (0.38) | ESR1ADRA2AADRA2BADRA2CCYP1A2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0268878-B1 | Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents | MITSUI TOATSU CHEMICALS (JP) | 1996-01-31 | — | — | EP | disclosed |
| US-5023366-A | Reacted with a benzyl halide, alcohol or ether; for pressure sensitive elements | MITSUI TOATSU CHEMICALS, INCORPORATED (JP) | 1991-06-11 | — | — | US | disclosed |
| EP-0268878-A2 | Salicylic acid copolymers and their metal salts, production process thereof, color-developing agents comprising metal salts of the copolymers and color-developing sheets employing the agents | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1988-06-01 | — | — | EP | disclosed |