Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 2/20 | 0.61 |
| ▸ | ADRA1D | P25100 | 2/20 | 0.61 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.61 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.61 |
| ▸ | FERMT2 | Q96AC1 | 1/20 | 0.50 |
| ▸ | BRD4 | O60885 | 3/20 | 0.49 |
| ▸ | HRH3 | Q9Y5N1 | 4/20 | 0.49 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL16596345 | 0.98 | HTR1A (0.58) | HTR1AADRA1DADRA1AADRA1BFERMT2 | |
| SCHEMBL23904665 | 0.84 | CCR1 (0.66) | FERMT2HRH3 | |
| SCHEMBL19563522 | 0.84 | CYP3A4 (0.49) | BRD4BCHE | |
| SCHEMBL19563557 | 0.83 | SMN1; SMN2 (0.60) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| SCHEMBL24863495 | 0.83 | ACACB (0.55) | BRD4BCHE | |
| SCHEMBL20434212 | 0.81 | HTR1A (0.71) | HTR1AADRA1DADRA1AADRA1BBRD4 | |
| SCHEMBL17981164 | 0.80 | PTPN1 (0.56) | HTR1AADRA1DADRA1AADRA1B | |
| Hydrochloric Acid SCHEMBL21410046 | 0.79 | CYP3A4 (0.48) | BRD4BCHE | |
| SCHEMBL17527064 | 0.79 | CDK1 (0.61) | FERMT2 | |
| SCHEMBL1034070 | 0.79 | BRD4 (0.47) | BRD4BCHE |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3046917-B1 | QUINAZOLINE DERIVATIVES AND THEIR USE AS DNA METHYLTRANSFERASE INHIBITORS | PF MEDICAMENT (FR) | 2017-11-08 | — | — | EP | disclosed |
| WO-2015040169-A1 | QUINAZOLINE DERIVATIVES AND THEIR USE AS DNA METHYLTRANSFERASE INHIBITORS | PIERRE FABRE MEDICAMENT (FR) | 2015-03-26 | — | — | WO | disclosed |