Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABRA1 | P14867 | 3/20 | 0.56 |
| ▸ | GABRB2 | P47870 | 3/20 | 0.56 |
| ▸ | GABRB1 | P18505 | 2/20 | 0.56 |
| ▸ | GABRA3 | P34903 | 2/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL4650809 | 0.87 | PRKAB2 (0.47) | GABRA1GABRB2GABRB1GABRA3KDM4E | |
| SCHEMBL10866870 | 0.86 | CYP1A2 (0.53) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL3274638 | 0.85 | CYP1A2 (0.60) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL1021821 | 0.83 | GABRA1 (0.80) | GABRA1GABRB2GABRB1GABRA3ALDH1A1 | |
| SCHEMBL19384676 | 0.82 | CLEC4M (0.49) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL4650007 | 0.82 | CYP1A2 (0.52) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL3639479 | 0.82 | GABRA1 (0.46) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL10867176 | 0.81 | CYP1A2 (0.48) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL10519192 | 0.80 | CLEC4M (0.53) | GABRA1GABRB2GABRB1GABRA3CYP1A2 | |
| SCHEMBL7258392 | 0.79 | CYP1A2 (0.76) | GABRA1GABRB2GABRB1GABRA3CYP1A2 |
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-1963271-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | Merck & Co., Inc. (US) | 2008-09-03 | — | — | EP | disclosed |
| WO-2007100366-A2 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2007-09-07 | — | — | WO | disclosed |
| WO-2007067489-A1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK & CO., INC. (US) | 2007-06-14 | — | — | WO | disclosed |