Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.37 |
| ▸ | RAB9A | P51151 | 3/20 | 0.37 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.35 |
| ▸ | CTSK | P43235 | 2/20 | 0.34 |
| ▸ | RAF1 | P04049 | 1/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.34 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.33 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.33 |
| ▸ | GCK | P35557 | 2/20 | 0.33 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.33 |
| ▸ | SCD | O00767 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5199425 | 0.82 | GRM5 (0.46) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2828553 | 0.81 | PIK3C3 (0.38) | GRM5LRRK2 | |
| SCHEMBL2826669 | 0.78 | IGF1R (0.35) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2831340 | 0.77 | NPC1 (0.47) | ALDH1A1SMN1; SMN2NPC1RAB9AGRM5 | |
| SCHEMBL2827806 | 0.77 | GRM5 (0.44) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2828949 | 0.76 | NPC1 (0.37) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2831219 | 0.76 | NPC1 (0.37) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 | |
| SCHEMBL2824596 | 0.75 | SMARCA2 (0.43) | NPC1RAB9AGRM5 | |
| SCHEMBL2827684 | 0.74 | GRM5 (0.48) | NPC1RAB9ANOTUMGRM5 | |
| SCHEMBL2829284 | 0.74 | NPC1 (0.41) | KDM4EALDH1A1LMNAHTTSMN1; SMN2 |
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 |