Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HRH1 | P35367 | 2/20 | 0.40 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.40 |
| ▸ | HRH2 | P25021 | 1/20 | 0.40 |
| ▸ | ACP1 | P24666 | 2/20 | 0.40 |
| ▸ | RAD52 | P43351 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.35 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.35 |
| ▸ | ADRA1B | P35368 | 2/20 | 0.35 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | CAMK2D | Q13557 | 1/20 | 0.35 |
| ▸ | NMT1 | P30419 | 1/20 | 0.35 |
| ▸ | POLR1A | O95602 | 1/20 | 0.34 |
| ▸ | HTR7 | P34969 | 2/20 | 0.34 |
| ▸ | HTR1A | P08908 | 1/20 | 0.34 |
| ▸ | DRD2 | P14416 | 1/20 | 0.34 |
| ▸ | HTR1D | P28221 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL19873425 | 0.83 | ACP1 (0.40) | HRH3ACP1NPC1RAB9AKAT2B | |
| SCHEMBL17721582 | 0.82 | ACP1 (0.45) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL16928554 | 0.81 | HRH2 (0.43) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL19873416 | 0.81 | NPY5R (0.37) | NPY5RHTR2AHTR2C | |
| SCHEMBL16928011 | 0.80 | ACP1 (0.48) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL16928222 | 0.80 | ACP1 (0.45) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL16928548 | 0.79 | NMT1 (0.48) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL16928133 | 0.79 | CHRM3 (0.39) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL16928309 | 0.79 | ACP1 (0.47) | HRH1HRH3HRH2ACP1RAD52 | |
| SCHEMBL19873411 | 0.78 | BRD4 (0.36) | HTR2AHTR2C |
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-2970153-B1 | TRIAZINE COMPOUNDS AND COMPOSITIONS THEREOF AND METHODS FOR TREATING MALARIA AND CHEMOPROPHYLAXIS | THE US SECRETARY OF THE ARMY ON BEHALF OF WALTER REED ARMY INSTITUTE OF RESEARCH (US) | 2018-02-21 | — | — | EP | claimed |