Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.34 |
| ▸ | HTR2C | P28335 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.33 |
| ▸ | KMO | O15229 | 1/20 | 0.31 |
| ▸ | PDE1A | P54750 | 1/20 | 0.31 |
| ▸ | PDE1B | Q01064 | 1/20 | 0.31 |
| ▸ | PDE1C | Q14123 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.31 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.30 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.30 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.30 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.30 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL3174711 | 0.74 | — | — | |
| SCHEMBL23937771 | 0.69 | HTR2A (0.37) | HTR2AHTR2CALDH1A1HPGDADORA3 | |
| SCHEMBL6404588 | 0.64 | KDM4E (0.46) | KDM4EALDH1A1HPGDNR3C1KMT2A | |
| SCHEMBL29350890 | 0.64 | RECQL (0.43) | KDM4EKMOPDE1APDE1BPDE1C | |
| SCHEMBL15723851 | 0.63 | HTR2A (0.56) | HTR2AHTR2CKDM4EKMOPTGER3 | |
| SCHEMBL24933951 | 0.63 | ADORA1 (0.36) | ADORA1 | |
| SCHEMBL363230 | 0.63 | ACLY (0.46) | HTR2AHTR2CKMONR3C1 | |
| SCHEMBL2052719 | 0.62 | ALDH1A1 (0.41) | KDM4EALDH1A1HPGDKMT2A | |
| SCHEMBL12565972 | 0.62 | PDE1A (0.33) | KDM4EPDE1APDE1BPDE1CALDH1A1 | |
| SCHEMBL16339750 | 0.61 | HDAC8 (0.47) | HTR2AHTR2CPDE1APDE1BPDE1C |
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-3399968-B1 | SELECTIVE INHIBITORS OF CLINICALLY IMPORTANT MUTANTS OF THE EGFR TYROSINE KINASE | CS PHARMATECH LTD (KY) | 2021-10-20 | — | — | EP | disclosed |