Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 11/20 | 0.81 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.42 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL5202469 | 0.90 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL3922587 | 0.72 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL5203630 | 0.71 | GRM5 (0.66) | GRM5ALDH1A1MAPTTSHR | |
| SCHEMBL2816133 | 0.71 | KDM4E (0.56) | KDM4EALDH1A1MAPTHTT | |
| SCHEMBL660355 | 0.70 | GRM5 (1.00) | GRM5 | |
| SCHEMBL5201985 | 0.69 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL5224021 | 0.68 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL3922456 | 0.68 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL30795243 | 0.68 | GRM5 (1.00) | GRM5KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL20051584 | 0.67 | GRM5 (0.59) | GRM5 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1458708-A4 | HETEROARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | MERCK & CO INC (US) | 2005-11-16 | — | — | EP | disclosed |
| EP-1458708-A2 | HETEROARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | Merck & Co., Inc. (US) | 2004-09-22 | — | — | EP | disclosed |
| WO-2003051315-A2 | HETEROARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | MERCK & CO., INC. (US) | 2003-06-26 | — | — | WO | disclosed |