Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | HTT | P42858 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | CYP1A1 | P04798 | 3/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP1B1 | Q16678 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 6/20 | 0.34 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.34 |
| ▸ | TOP2A | P11388 | 1/20 | 0.34 |
| ▸ | PADI4 | Q9UM07 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL4732088 | 0.85 | MEN1 (0.45) | RAB9AMEN1ALDH1A1LMNAPOLB | |
| SCHEMBL8215908 | 0.80 | CNR2 (0.36) | RAB9AMEN1ALDH1A1LMNAPOLB | |
| SCHEMBL8213285 | 0.79 | MAPT (0.45) | RAB9AALDH1A1POLBMAPTKMT2A | |
| SCHEMBL8219508 | 0.77 | LMNA (0.40) | RAB9AMEN1ALDH1A1LMNAPOLB | |
| SCHEMBL8213322 | 0.76 | PDGFRB (0.42) | MEN1ALDH1A1LMNAPOLBGAA | |
| SCHEMBL8214695 | 0.75 | ALDH1A1 (0.40) | RAB9AMEN1ALDH1A1LMNAPOLB | |
| SCHEMBL8266779 | 0.74 | MAOB (0.44) | RAB9AMEN1ALDH1A1LMNAPOLB | |
| SCHEMBL8207163 | 0.74 | ALDH1A1 (0.46) | RAB9AMEN1ALDH1A1LMNAGAA | |
| SCHEMBL8219294 | 0.72 | HPGDS (0.41) | KMT2ASMN1; SMN2 | |
| SCHEMBL8266559 | 0.72 | JUN (0.50) | MEN1ALDH1A1LMNAPOLBGAA |
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-2008035049-A1 | ADAMANTANYL-(CYCLOPROPYL)-KETONES AS METABOTROPIC GLUTAMATE RECEPTOR MODULATORS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2008-03-27 | — | — | WO | disclosed |