Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 1/20 | 0.58 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | HTT | P42858 | 1/20 | 0.49 |
| ▸ | APP | P05067 | 2/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.48 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.48 |
| ▸ | DRD2 | P14416 | 1/20 | 0.48 |
| ▸ | DRD4 | P21917 | 1/20 | 0.48 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.48 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.48 |
| ▸ | ADRA1B | P35368 | 1/20 | 0.48 |
| ▸ | DRD3 | P35462 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL2211592 | 0.98 | CHRNB2 (0.60) | CHRNB2CHRNA4KDM4ELMNAMAPT | |
| SCHEMBL16667635 | 0.87 | KDM4E (0.59) | KDM4ELMNAMAPTHTTMEN1 | |
| SCHEMBL16669059 | 0.87 | KDM4E (0.59) | KDM4ELMNAMAPTHTTMEN1 | |
| SCHEMBL15219217 | 0.85 | KDM4E (0.57) | KDM4ELMNAMAPTHTTMEN1 | |
| SCHEMBL29510932 | 0.85 | CHRNB2 (0.69) | CHRNB2CHRNA4LMNAAPPDRD2 | |
| SCHEMBL1470185 | 0.85 | CHRNB2 (0.69) | CHRNB2CHRNA4LMNAAPPDRD2 | |
| SCHEMBL23975528 | 0.82 | CHRNB2 (0.53) | CHRNB2CHRNA4APPDRD2DRD4 | |
| 1-Hydroxy-3-Propoxybenzene SCHEMBL875629 | 0.82 | CHRNB2 (0.66) | CHRNB2CHRNA4APPKMT2ADRD2 | |
| 1-Hydroxy-3-Propoxybenzene SCHEMBL29459552 | 0.82 | CHRNB2 (0.66) | CHRNB2CHRNA4APPKMT2ADRD2 | |
| 1-Hydroxy-3-Ethoxybenzene SCHEMBL365637 | 0.81 | CHRNB2 (0.59) | CHRNB2CHRNA4KDM4EMAPTAPP |
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-3609869-A1 | SUBSTITUTED N-ARYLETHYL-2-ARYLQUINOLINE-4-CARBOXAMIDES AND USE THEREOF | Bayer Aktiengesellschaft (DE) | 2020-02-19 | — | — | EP | disclosed |