Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 3/20 | 0.51 |
| ▸ | MAPT | P10636 | 2/20 | 0.51 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.51 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.51 |
| ▸ | CASP3 | P42574 | 1/20 | 0.46 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.46 |
| ▸ | SENP7 | Q9BQF6 | 1/20 | 0.46 |
| ▸ | SENP6 | Q9GZR1 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL15033985 | 0.91 | SMN1; SMN2 (0.52) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15046451 | 0.89 | MEN1 (0.53) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15046476 | 0.88 | MAPT (0.52) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15033984 | 0.86 | GABRA2 (0.58) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15033980 | 0.81 | MAPT (0.52) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15034550 | 0.79 | RAB9A (0.54) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15043866 | 0.78 | GABRB2 (0.45) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15034552 | 0.78 | GRM5 (0.53) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15046452 | 0.78 | MAPT (0.52) | RAB9ASMN1; SMN2NPC1LMNAMAPT | |
| SCHEMBL15034549 | 0.77 | GRM5 (0.47) | RAB9ASMN1; SMN2NPC1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013087806-A1 | PIPERAZINE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLU5 RECEPTORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-06-20 | — | — | WO | disclosed |