Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.40 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.40 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.40 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.40 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.40 |
| ▸ | CTSD | P07339 | 1/20 | 0.38 |
| ▸ | BACE1 | P56817 | 1/20 | 0.38 |
| ▸ | ADH1B | P00325 | 1/20 | 0.35 |
| ▸ | ADH1C | P00326 | 1/20 | 0.35 |
| ▸ | ADH1A | P07327 | 1/20 | 0.35 |
| ▸ | ADH4 | P08319 | 1/20 | 0.35 |
| ▸ | ADH7 | P40394 | 1/20 | 0.35 |
| ▸ | TMEM97 | Q5BJF2 | 4/20 | 0.35 |
| ▸ | EPHX1 | P07099 | 2/20 | 0.34 |
| ▸ | GLB1 | P16278 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | MGAM | O43451 | 1/20 | 0.34 |
| ▸ | SI | P14410 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL21574126 | 0.81 | CYP2D6 (0.44) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL19406793 | 0.79 | HTT (0.36) | TMEM97HTT | |
| SCHEMBL1679281 | 0.79 | ADH1B (0.46) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL1678637 | 0.79 | ADH1B (0.46) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL1679116 | 0.79 | ADH1B (0.46) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL19561678 | 0.78 | CHRM2 (0.41) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL13074166 | 0.77 | KCNH2 (0.40) | HTT | |
| Ammonia Solution, Strong SCHEMBL2936833 | 0.77 | ADH1B (0.44) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL1678793 | 0.76 | ADH1B (0.42) | CHRM2CHRM4CHRM5ADRA2BADRA2C | |
| SCHEMBL23744926 | 0.74 | EPHX1 (0.48) | CHRM2CHRM4CHRM5ADRA2BADRA2C |
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-3392257-B1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE ORGANOMETALLIC COMPOUND, AND DIAGNOSTIC COMPOSITION INCLUDING THE ORGANOMETALLIC COMPOUND | SAMSUNG ELECTRONICS CO LTD (KR) | 2020-06-10 | — | — | EP | disclosed |