Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | NPC1 | O15118 | 2/20 | 0.44 |
| ▸ | SCD | O00767 | 7/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | GRM5 | P41594 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | GCK | P35557 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829129 | 0.85 | GRM5 (0.41) | RAB9ANPC1CYP3A4DRD3GRM5 | |
| SCHEMBL2828498 | 0.81 | GRM5 (0.44) | RAB9ANPC1SCDGRM5ROCK2 | |
| SCHEMBL2830868 | 0.80 | MAPT (0.46) | RAB9ANPC1TSHRKDM4ESMN1; SMN2 | |
| SCHEMBL2829064 | 0.78 | GRM5 (0.41) | RAB9ANPC1CYP3A4DRD3GRM5 | |
| SCHEMBL2831340 | 0.78 | NPC1 (0.47) | RAB9ANPC1SCDGRM5TSHR | |
| SCHEMBL2828127 | 0.77 | SMARCA2 (0.42) | RAB9ANPC1GRM5GCKSMN1; SMN2 | |
| SCHEMBL2832249 | 0.75 | MAPT (0.37) | RAB9ANPC1TSHRKDM4ELMNA | |
| SCHEMBL2828836 | 0.74 | NPC1 (0.42) | RAB9ANPC1TSHRKDM4EMAPK1 | |
| SCHEMBL2828434 | 0.74 | MAPT (0.50) | RAB9ANPC1ROCK2ROCK1TSHR | |
| SCHEMBL2830798 | 0.74 | GRM5 (0.44) | RAB9ANPC1CYP3A4DRD3GRM5 |
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 |