Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 2/20 | 0.48 |
| ▸ | GRM5 | P41594 | 6/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | HPGDS | O60760 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | KDR | P35968 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | DCTPP1 | Q9H773 | 1/20 | 0.40 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.39 |
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | SYK | P43405 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | NPC1 | O15118 | 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 | |
|---|---|---|---|---|
| SCHEMBL5470984 | 0.88 | GRM5 (0.53) | ATMGRM5KDRKDM4EMEN1 | |
| SCHEMBL29050578 | 0.78 | GRM5 (0.53) | ATMGRM5MAPTKDRKDM4E | |
| SCHEMBL14668861 | 0.78 | ERN1 (0.48) | ATMGRM5ALDH1A1MAPTGAA | |
| SCHEMBL28710992 | 0.76 | SYK (0.50) | ATMGRM5ALDH1A1MAPTKDM4E | |
| SCHEMBL5833461 | 0.76 | KDM4E (0.43) | GRM5ALDH1A1MAPTKDRKDM4E | |
| SCHEMBL8338124 | 0.74 | HTT (0.48) | ATMGRM5MEN1KMT2A | |
| SCHEMBL5668689 | 0.73 | GRM5 (0.50) | ATMGRM5ALDH1A1MAPTGAA | |
| Hydrochloric Acid SCHEMBL5315800 | 0.73 | HTT (0.47) | ATMGRM5MEN1KMT2A | |
| SCHEMBL5479059 | 0.73 | GUSB (0.42) | ATMGRM5ALDH1A1MAPTGAA | |
| SCHEMBL13683940 | 0.72 | GRM5 (0.53) | GRM5KDM4EMEN1KMT2ADCTPP1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1613617-A4 | DI-ARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | MERCK & CO INC (US) | 2009-02-18 | — | — | EP | disclosed |
| US-7268151-B2 | Di-aryl substituted triazole modulators of metabotropic glutamate receptor-5 | MERCK & CO., INC. (US) | 2007-09-11 | — | — | US | disclosed |
| US-20070082067-A1 | Di-aryl substituted triazole modulators of metabotropic glutamate receptor-5 | MERCK SHARP & DOHME CORP. | 2007-04-12 | — | — | US | disclosed |
| EP-1613617-A2 | DI-ARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | Merck & Co., Inc. (US) | 2006-01-11 | — | — | EP | disclosed |
| WO-2004089306-A2 | DI-ARYL SUBSTITUTED TRIAZOLE MODULATORS OF METABOTROPIC GLUTAMATE RECEPTOR-5 | MERCK & CO., INC. (US) | 2004-10-21 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20070082067-A1 | Di-aryl substituted triazole modulators of metabotropic glutamate receptor-5 | GRM5, GRM1, GRIA3 | ATM 4142/4885GRM5 1/4885ALDH1A1 740/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.