Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.58 |
| ▸ | RAB9A | P51151 | 5/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.58 |
| ▸ | GRM5 | P41594 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 1/20 | 0.47 |
| ▸ | SYK | P43405 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | GBA1 | P04062 | 2/20 | 0.39 |
| ▸ | CDK4 | P11802 | 1/20 | 0.39 |
| ▸ | CDK2 | P24941 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL2829479 | 0.89 | NPC1 (0.43) | NPC1RAB9ASMN1; SMN2GRM5ALDH1A1 | |
| SCHEMBL2829743 | 0.88 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2GRM5ABCG2 | |
| SCHEMBL2830126 | 0.86 | NPC1 (0.42) | NPC1RAB9ASMN1; SMN2GRM5LMNA | |
| SCHEMBL2830797 | 0.86 | RAB9A (0.51) | NPC1RAB9ASMN1; SMN2GRM5MEN1 | |
| SCHEMBL2826737 | 0.85 | RAB9A (0.56) | NPC1RAB9ASMN1; SMN2GRM5MEN1 | |
| SCHEMBL2824780 | 0.85 | ALDH1A1 (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1MEN1 | |
| SCHEMBL2826324 | 0.84 | NPC1 (0.58) | NPC1RAB9ASMN1; SMN2GRM5ALDH1A1 | |
| SCHEMBL2830129 | 0.84 | CYP1A2 (0.44) | NPC1RAB9ASMN1; SMN2GRM5ALDH1A1 | |
| SCHEMBL2825977 | 0.82 | GRM5 (0.50) | NPC1RAB9ASMN1; SMN2GRM5MEN1 | |
| SCHEMBL2828556 | 0.81 | MAOB (0.46) | NPC1RAB9AALDH1A1LMNAMEN1 |
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 |