Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.35 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | CHRM5 | P08912 | 1/20 | 0.35 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | ADRA1D | P25100 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL22703726 | 0.83 | MAPT (0.39) | HTTLMNAMAPK1MAPTBCHE | |
| SCHEMBL5337084 | 0.82 | CHRM1 (0.48) | HTTLMNAMAPK1MAPTKDM4E | |
| SCHEMBL22703728 | 0.78 | PKM (0.39) | HTTMAPTBCHEPOLBHPGD | |
| SCHEMBL18799668 | 0.76 | ALOX5 (0.46) | HTTMAPTMEN1KMT2A | |
| SCHEMBL16508867 | 0.75 | SMN1; SMN2 (0.41) | MAPTKDM4EBCHEPOLBCHRM1 | |
| SCHEMBL21431284 | 0.71 | BCHE (0.38) | MAPTBCHECYP1A2CA1CA2 | |
| SCHEMBL14754887 | 0.71 | — | — | |
| SCHEMBL22703732 | 0.71 | TLR4 (0.32) | TLR4 | |
| SCHEMBL16508743 | 0.70 | SMN1; SMN2 (0.43) | KDM4EBCHEPOLBPKMAPEX1 | |
| SCHEMBL563774 | 0.69 | APEX1 (0.54) | HTTCYP1A2PKMAPEX1BLM |
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-3156410-A1 | POLYENE MACROLIDE DERIVATIVE | SHIONOGI & CO., LTD. (JP) | 2017-04-19 | — | — | EP | disclosed |