Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.49 |
| ▸ | MMP2 | P08253 | 2/20 | 0.46 |
| ▸ | MMP3 | P08254 | 1/20 | 0.46 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.43 |
| ▸ | ADAM10 | O14672 | 1/20 | 0.42 |
| ▸ | MMP9 | P14780 | 1/20 | 0.42 |
| ▸ | PPARG | P37231 | 1/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | WDR5 | P61964 | 1/20 | 0.42 |
| ▸ | NCOA1 | Q15788 | 1/20 | 0.42 |
| ▸ | NCOA3 | Q9Y6Q9 | 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 | |
|---|---|---|---|---|
| SCHEMBL5542027 | 0.84 | QDPR (0.58) | MEN1KMT2APPARGPPARA | |
| SCHEMBL5542022 | 0.82 | MEN1 (0.49) | MEN1KMT2AMMP2MMP3PARP1 | |
| SCHEMBL13801238 | 0.80 | MEN1 (0.47) | MEN1KMT2AMMP2MMP3PARP1 | |
| SCHEMBL8352095 | 0.80 | MEN1 (0.59) | MEN1KMT2AMMP2MMP3PARP1 | |
| SCHEMBL6772949 | 0.78 | TDP1 (0.55) | MEN1KMT2AMMP2MMP3PARP1 | |
| SCHEMBL9377137 | 0.77 | DYRK1A (0.50) | ALDH1A1GAAWDR5NCOA1NCOA3 | |
| SCHEMBL9080596 | 0.77 | ALDH1A1 (0.50) | MEN1KMT2AKDM4EALDH1A1 | |
| SCHEMBL7398716 | 0.77 | MMP2 (0.52) | MEN1KMT2AMMP2MMP3AOC3 | |
| SCHEMBL4827185 | 0.76 | MEN1 (0.71) | MEN1KMT2APARP1PPARGPPARA | |
| Hydrochloric Acid SCHEMBL10356848 | 0.76 | ALDH1A1 (0.49) | MEN1KMT2AKDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013083741-A1 | 1,2,4 -TRIAZOLES AS ALLOSTERIC MODULATORS OF MGLU5 RECEPTOR ACTIVITY FOR THE TREATMENT OF SCHIZOPHRENIA OF DEMENTIA | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2013-06-13 | — | — | WO | disclosed |