Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 6/20 | 0.43 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.43 |
| ▸ | IDO1 | P14902 | 2/20 | 0.43 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | PTGDR2 | Q9Y5Y4 | 2/20 | 0.41 |
| ▸ | TP53 | P04637 | 2/20 | 0.41 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.41 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | AKR1A1 | P14550 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL3230356 | 0.86 | IDO1 (0.50) | AKR1B1AKR1B10IDO1MAPTPTGDR2 | |
| SCHEMBL3233866 | 0.84 | AKR1B1 (0.53) | AKR1B1MAPTTP53AKR1A1MEN1 | |
| SCHEMBL3238778 | 0.81 | CHRM1 (0.48) | AKR1B1MAPTTP53RXFP1TBXA2R | |
| SCHEMBL3242119 | 0.81 | PTGDR2 (0.48) | MAPTPTGDR2TP53RXFP1HPGD | |
| SCHEMBL3233811 | 0.77 | CHRM1 (0.47) | MAPTPTGDR2TP53RXFP1SMN1; SMN2 | |
| SCHEMBL3237092 | 0.76 | GAA (0.50) | MAPTTP53RXFP1THRBLMNA | |
| SCHEMBL2487940 | 0.76 | CHRM1 (0.44) | MAPTTP53RXFP1LMNA | |
| SCHEMBL8317397 | 0.75 | ICMT (0.52) | TP53THRB | |
| SCHEMBL18783762 | 0.72 | PTGER1 (0.49) | TBXA2R | |
| SCHEMBL9046561 | 0.72 | EPHA2 (0.39) | HPGDTHRBLMNAMEN1CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1963271-B1 | QUINOLONE M1 RECEPTOR POSITIVE ALLOSTERIC MODULATORS | MERCK SHARP & DOHME (US) | 2010-07-28 | — | — | EP | claimed |