Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 8/20 | 0.43 |
| ▸ | RAB9A | P51151 | 7/20 | 0.43 |
| ▸ | GRM5 | P41594 | 5/20 | 0.43 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | GBA1 | P04062 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL2830110 | 0.85 | RAB9A (0.46) | NPC1RAB9AGRM5KMT2AKDM4E | |
| SCHEMBL2832205 | 0.85 | RAB9A (0.41) | NPC1RAB9AGRM5KMT2AKDM4E | |
| SCHEMBL2826574 | 0.84 | ALDH1A1 (0.47) | NPC1RAB9AGRM5KMT2AKDM4E | |
| SCHEMBL2829836 | 0.84 | RAB9A (0.42) | NPC1RAB9AGRM5KMT2AKDM4E | |
| SCHEMBL2830797 | 0.81 | RAB9A (0.51) | NPC1RAB9AGRM5KMT2AMAPT | |
| SCHEMBL2824990 | 0.81 | RAB9A (0.51) | NPC1RAB9AGRM5ASIC3KMT2A | |
| SCHEMBL2825843 | 0.81 | GRM5 (0.58) | NPC1RAB9AGRM5KMT2ASMN1; SMN2 | |
| SCHEMBL2831443 | 0.81 | RAB9A (0.49) | NPC1RAB9AGRM5KMT2AMAPT | |
| SCHEMBL2826324 | 0.80 | NPC1 (0.58) | NPC1RAB9AGRM5KMT2AKDM4E | |
| SCHEMBL2830006 | 0.79 | RAB9A (0.44) | NPC1RAB9AGRM5KMT2AMAPT |
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 |