Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | HPGD | P15428 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.45 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.45 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.45 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.45 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.45 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | MDH2 | P40926 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.40 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.40 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.40 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.40 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.40 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL4649992 | 0.89 | KDM4E (0.47) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL4649441 | 0.81 | KDM4E (0.53) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL4650115 | 0.80 | KDM4E (0.41) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL4650138 | 0.77 | CSNK2A2 (0.41) | KDM4ECYP1A2PRKAB2PRKAG1PRKAA2 | |
| SCHEMBL2979894 | 0.77 | KDM4E (0.68) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL4342972 | 0.77 | CYP1A2 (0.62) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL2978428 | 0.77 | KDM4E (0.67) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL4650040 | 0.75 | KDM4E (0.46) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL17242475 | 0.74 | KDM4E (0.60) | KDM4EHPGDALDH1A1CYP1A2MEN1 | |
| SCHEMBL17338533 | 0.72 | ALDH1A1 (0.54) | KDM4EHPGDALDH1A1GABRA1GABRB1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1963271-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | Merck & Co., Inc. (US) | 2008-09-03 | — | — | EP | claimed |
| WO-2007067489-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2007-06-14 | — | — | WO | claimed |