Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | RXFP1 | Q9HBX9 | 3/20 | 0.60 |
| ▸ | PRNP | P04156 | 1/20 | 0.60 |
| ▸ | PPARG | P37231 | 1/20 | 0.60 |
| ▸ | NR2E3 | Q9Y5X4 | 1/20 | 0.60 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.60 |
| ▸ | DPP4 | P27487 | 2/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.45 |
| ▸ | CASP3 | P42574 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | FABP3 | P05413 | 1/20 | 0.43 |
| ▸ | FABP4 | P15090 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | PTGFR | P43088 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5178272 | 0.77 | RXFP1 (0.60) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL2822472 | 0.77 | ALDH1A1 (1.00) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL27684995 | 0.76 | RXFP1 (0.65) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL2825415 | 0.76 | PRNP (0.72) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL3903825 | 0.75 | DPP4 (0.69) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL2822202 | 0.74 | ALDH1A1 (0.67) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL2821515 | 0.73 | RXFP1 (0.81) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL2821491 | 0.73 | RXFP1 (0.75) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL3895184 | 0.73 | DPP4 (0.78) | ALDH1A1RXFP1PRNPPPARGNR2E3 | |
| SCHEMBL5178617 | 0.72 | ALDH1A1 (0.55) | ALDH1A1RXFP1PRNPPPARGNR2E3 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1809605-A1 | QUINOLINE AS ALLOSTERIC ENHANCERS OF THE GABA-B RECEPTORS | F. Hoffmann-Roche AG (CH) | 2007-07-25 | — | — | EP | claimed |
| WO-2006048146-A1 | QUINOLINE AS ALLOSTERIC ENHANCERS OF THE GABA-B RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-05-11 | — | — | WO | claimed |
| EP-1809605-A1 | QUINOLINE AS ALLOSTERIC ENHANCERS OF THE GABA-B RECEPTORS | F. Hoffmann-Roche AG (CH) | 2007-07-25 | — | — | EP | disclosed |
| WO-2006048146-A1 | QUINOLINE AS ALLOSTERIC ENHANCERS OF THE GABA-B RECEPTORS | F. HOFFMANN-LA ROCHE AG (CH) | 2006-05-11 | — | — | WO | disclosed |