Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.55 |
| ▸ | CA2 | P00918 | 1/20 | 0.55 |
| ▸ | CA9 | Q16790 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 5/20 | 0.54 |
| ▸ | RAB9A | P51151 | 5/20 | 0.54 |
| ▸ | GRM5 | P41594 | 3/20 | 0.52 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MEN1 | O00255 | 3/20 | 0.47 |
| ▸ | GFER | P55789 | 1/20 | 0.47 |
| ▸ | NHERF1 | O14745 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2826005 | 0.90 | GRM5 (0.50) | NPC1RAB9AGRM5L3MBTL1ALDH1A1 | |
| SCHEMBL2830779 | 0.85 | GRM5 (0.71) | CA12CA2CA9NPC1RAB9A | |
| SCHEMBL2826379 | 0.84 | GRM5 (0.48) | NPC1RAB9AGRM5L3MBTL1ALDH1A1 | |
| SCHEMBL2828501 | 0.83 | GRM5 (0.69) | CA12CA2CA9NPC1RAB9A | |
| SCHEMBL10593099 | 0.79 | RHOA (0.56) | CA12CA2CA9NPC1RAB9A | |
| SCHEMBL2827691 | 0.77 | BRD4 (0.48) | GRM5L3MBTL1ALDH1A1KMT2AMEN1 | |
| SCHEMBL2826666 | 0.76 | ROCK1 (0.46) | GRM5L3MBTL1KMT2AMEN1POLB | |
| SCHEMBL2829389 | 0.76 | GRM5 (0.69) | RAB9AGRM5ALDH1A1MAPTSMN1; SMN2 | |
| SCHEMBL2828221 | 0.75 | LDHA (0.51) | RAB9AGRM5L3MBTL1ALDH1A1KMT2A | |
| SCHEMBL1811760 | 0.73 | KCNK3 (0.79) | NPC1RAB9AL3MBTL1KMT2AMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1844044-B1 | THIAZOLE-4-CARBOXAMIDE DERIVATIVES AS MGLUR5 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2010-07-21 | — | — | EP | claimed |