Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | HTR1B | P28222 | 2/20 | 0.58 |
| ▸ | HTR1D | P28221 | 1/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | NSD2 | O96028 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.49 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.49 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.48 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.45 |
| ▸ | DRD4 | P21917 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL13881784 | 0.98 | KDM4E (0.57) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL13881713 | 0.95 | KDM4E (0.60) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL13881829 | 0.90 | HTR1B (0.61) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL8928374 | 0.86 | PRSS1 (0.53) | ALDH1A1TSHR | |
| SCHEMBL13862313 | 0.85 | CHRM2 (0.50) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL25822229 | 0.85 | CYP1A2 (0.67) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL25822245 | 0.85 | HTR1B (0.59) | KDM4EHTR1BHTR1DALDH1A1NSD2 | |
| SCHEMBL8928364 | 0.84 | PRSS1 (0.55) | ALDH1A1TSHR | |
| SCHEMBL13881783 | 0.83 | CHRM2 (0.51) | KDM4EHTR1BALDH1A1NSD2SMN1; SMN2 | |
| SCHEMBL13881949 | 0.82 | CHRM2 (0.50) | KDM4EHTR1BALDH1A1NSD2SMN1; SMN2 |
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-3210966-A1 | ALKOXYPHENYLPROPYLAMINES FOR THE TREATMENT OF AGE-RELATED MACULAR DEGENERATION | Acucela, Inc. (US) | 2017-08-30 | — | — | EP | disclosed |