Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | PKLR | P30613 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.37 |
| ▸ | MAOA | P21397 | 1/20 | 0.37 |
| ▸ | MAOB | P27338 | 1/20 | 0.37 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.37 |
| ▸ | BRD1 | O95696 | 1/20 | 0.37 |
| ▸ | BRPF1 | P55201 | 1/20 | 0.37 |
| ▸ | COXFA4 | O00483 | 1/20 | 0.37 |
| ▸ | MGAM | O43451 | 3/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | SI | P14410 | 3/20 | 0.36 |
| ▸ | MGAM2 | Q2M2H8 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | PLCG2 | P16885 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL10238811 | 0.79 | MAPT (0.45) | PKMMAPTNPC1RAB9APKLR | |
| SCHEMBL13979639 | 0.78 | NPC1 (0.44) | PKMMAPTNPC1RAB9APKLR | |
| SCHEMBL13877343 | 0.77 | MAPT (0.43) | PKMMAPTNPC1RAB9APKLR | |
| Hydrochloric Acid SCHEMBL27777901 | 0.75 | MAPT (0.42) | PKMMAPTNPC1RAB9APKLR | |
| Hydrochloric Acid SCHEMBL4372394 | 0.75 | MAPT (0.42) | PKMMAPTNPC1RAB9APKLR | |
| SCHEMBL670625 | 0.75 | PKM (0.45) | PKMMAPTNPC1RAB9APKLR | |
| SCHEMBL6181849 | 0.75 | HDAC3 (0.52) | PKMMAPTKCNH2 | |
| SCHEMBL3822007 | 0.74 | COXFA4 (0.52) | PKMMAPTNPC1RAB9APKLR | |
| SCHEMBL12466081 | 0.72 | KDM1A (0.50) | PKMMAPTNPC1RAB9ACTSB | |
| SCHEMBL669764 | 0.72 | MAPT (0.47) | PKMMAPTNPC1RAB9APKLR |
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-2670744-A1 | PYRROLE DERIVATIVES USED AS MODULATORS OF ALPHA7 NACHR | Lupin Limited (IN) | 2013-12-11 | — | — | EP | disclosed |
| WO-2012104782-A1 | PYRROLE DERIVATIVES USED AS MODULATORS OF ALPHA7 NACHR | LUPIN LIMITED (IN) | 2012-08-09 | — | — | WO | disclosed |