Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MRGPRX4 | Q96LA9 | 4/20 | 0.51 |
| ▸ | GPR52 | Q9Y2T5 | 5/20 | 0.45 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.44 |
| ▸ | PHGDH | O43175 | 1/20 | 0.44 |
| ▸ | SCD | O00767 | 3/20 | 0.43 |
| ▸ | MAOB | P27338 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.42 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.42 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.41 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.41 |
| ▸ | HTR1A | P08908 | 1/20 | 0.41 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL581494 | 0.94 | MRGPRX4 (0.51) | MRGPRX4GPR52NR3C2PHGDHSCD | |
| SCHEMBL581445 | 0.81 | MRGPRX4 (0.46) | MRGPRX4NR3C2PHGDHMAOB | |
| SCHEMBL581317 | 0.79 | GPR52 (0.46) | MRGPRX4GPR52CYP3A4 | |
| SCHEMBL580683 | 0.79 | MRGPRX4 (0.55) | MRGPRX4NR3C2MAOBMEN1KMT2A | |
| SCHEMBL1568281 | 0.79 | GPR52 (0.57) | MRGPRX4GPR52NR3C2MAOB | |
| SCHEMBL580585 | 0.77 | KDM5B (0.56) | — | |
| SCHEMBL3492157 | 0.76 | KDM5A (0.55) | MRGPRX4GPR52NR3C2PHGDH | |
| SCHEMBL40183 | 0.76 | MEN1 (0.68) | MRGPRX4CYP1A2CYP3A4CYP2D6MEN1 | |
| SCHEMBL7776064 | 0.75 | HTR2B (0.46) | GPR52MAOBCYP1A2CYP3A4CYP2D6 | |
| SCHEMBL31750237 | 0.75 | HTR2B (0.46) | GPR52MAOBCYP1A2CYP3A4CYP2D6 |
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-2417131-A1 | ISOXAZOL-3(2H)-ONE ANALOGS AS THERAPEUTIC AGENTS | AstraZeneca AB (SE) | 2012-02-15 | — | — | EP | disclosed |
| WO-2010117323-A1 | METHOD AND APPARATUS FOR PRODUCING HEAT ENERGY AND CARBON DIOXIDE | ASTRAZENECA AB (SE) | 2010-10-14 | — | — | WO | disclosed |