Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | RECQL | P46063 | 1/20 | 0.46 |
| ▸ | DRD2 | P14416 | 2/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.40 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | GRM1 | Q13255 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | PANK3 | Q9H999 | 1/20 | 0.38 |
| ▸ | BCL6 | P41182 | 1/20 | 0.38 |
| ▸ | ELANE | P08246 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL2658855 | 0.78 | KDM4E (0.40) | KDM4ERECQLDRD2HTR2AALDH1A1 | |
| SCHEMBL25427898 | 0.78 | KDM4E (0.46) | KDM4ERECQLDRD2HTR2AALDH1A1 | |
| SCHEMBL31247608 | 0.76 | KDM4E (0.46) | KDM4ERECQLDRD2HTR2AALDH1A1 | |
| SCHEMBL950862 | 0.76 | ALDH1A1 (0.43) | KDM4ERECQLDRD2HTR2AALDH1A1 | |
| SCHEMBL23754789 | 0.76 | GRIN2D (0.42) | KDM4EHSD11B1HDAC2CA12CA1 | |
| SCHEMBL27744470 | 0.75 | KMT2A (0.49) | KDM4EALDH1A1MAPTKMT2ACA12 | |
| SCHEMBL7130873 | 0.73 | CYP2E1 (0.46) | KDM4ERECQLDRD2HTR2AALDH1A1 | |
| SCHEMBL28417261 | 0.72 | HSD11B1 (0.48) | HSD11B1 | |
| SCHEMBL1882886 | 0.72 | GRIA1 (0.45) | KDM4EALDH1A1TDP1 | |
| SCHEMBL2918046 | 0.70 | GRIA1 (0.56) | — |
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-2003093273-A1 | IMIDAZO-TRIAZINE DERIVATIVES AS LIGANDS FOR GABA RECEPTORS | MERCK SHARP & DOHME LIMITED (GB) | 2003-11-13 | — | — | WO | disclosed |