Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 6/20 | 0.45 |
| ▸ | NPC1 | O15118 | 5/20 | 0.45 |
| ▸ | LMNA | P02545 | 4/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HTT | P42858 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 6/20 | 0.35 |
| ▸ | GABRG2 | P18507 | 6/20 | 0.35 |
| ▸ | GABRB3 | P28472 | 6/20 | 0.35 |
| ▸ | GABRA3 | P34903 | 6/20 | 0.35 |
| ▸ | GABRA2 | P47869 | 4/20 | 0.35 |
| ▸ | GABRA5 | P31644 | 3/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.35 |
| ▸ | GABRA6 | Q16445 | 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 | |
|---|---|---|---|---|
| SCHEMBL14239835 | 0.84 | RAB9A (0.43) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14239129 | 0.83 | RAB9A (0.38) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14239122 | 0.83 | RAB9A (0.38) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14239931 | 0.83 | CYP19A1 (0.39) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL12059055 | 0.82 | ALDH1A1 (0.43) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14239132 | 0.81 | ALDH1A1 (0.44) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14240291 | 0.81 | RAB9A (0.43) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14238841 | 0.81 | ALDH1A1 (0.41) | RAB9ANPC1ALDH1A1HTTMAPT | |
| SCHEMBL20756325 | 0.81 | SMN1; SMN2 (0.50) | RAB9ANPC1LMNAALDH1A1HTT | |
| SCHEMBL14239953 | 0.81 | NPC1 (0.44) | RAB9ANPC1LMNAALDH1A1MAPT |
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-2012170845-A2 | METABOTROPIC GLUTAMATE RECEPTOR 5 MODULATORS AND METHODS OF USE THEREOF | HEFFERNAN MICHELE L R (US) | 2012-12-13 | — | — | WO | disclosed |