Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.43 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 1/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.39 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | MAOB | P27338 | 1/20 | 0.38 |
| ▸ | PRSS1 | P07477 | 6/20 | 0.37 |
| ▸ | KCNA3 | P22001 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8155382 | 0.89 | SMN1; SMN2 (0.50) | SMN1; SMN2NPC1MAPTRAB9AMAPK1 | |
| SCHEMBL4737237 | 0.85 | TP53 (0.45) | SMN1; SMN2MAPK1MTNR1AMTNR1BMAOB | |
| SCHEMBL19439532 | 0.80 | MAPT (0.66) | SMN1; SMN2NPC1MAPTRAB9AMAPK1 | |
| SCHEMBL1770655 | 0.80 | MAPK1 (0.61) | MAPK1MTNR1AMTNR1BMAOBCYP1A2 | |
| SCHEMBL5726997 | 0.80 | MAPK1 (0.56) | MAPTRAB9AMAPK1CYP1A2CYP2D6 | |
| SCHEMBL1497882 | 0.80 | MAOB (0.49) | SMN1; SMN2NPC1MAPTRAB9AMAOA | |
| SCHEMBL30674601 | 0.80 | MAPK1 (0.61) | MAPK1MTNR1AMTNR1BMAOBCYP1A2 | |
| SCHEMBL30044154 | 0.80 | MAOB (0.49) | SMN1; SMN2NPC1MAPTRAB9AMAOA | |
| SCHEMBL7614389 | 0.80 | KMT2A (0.54) | SMN1; SMN2NPC1MAPTRAB9AMAPK1 | |
| SCHEMBL3720181 | 0.79 | CETP (0.42) | SMN1; SMN2NPC1MAPTRAB9AMAOB |
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-3233077-A1 | DOPAMINE D2 RECEPTOR LIGANDS | The Broad Institute Inc. (US) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016100940-A1 | DOPAMINE D2 RECEPTOR LIGANDS | THE BROAD INSTITUTE, INC. (US) | 2016-06-23 | — | — | WO | disclosed |