Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | SMPD3 | Q9NY59 | 1/20 | 0.50 |
| ▸ | CRHBP | P24387 | 1/20 | 0.49 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.49 |
| ▸ | GAA | P10253 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | THRB | P10828 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | BLM | P54132 | 1/20 | 0.44 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.44 |
| ▸ | LGMN | Q99538 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | CNR2 | P34972 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL31570599 | 0.82 | SMPD3 (0.53) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL939415 | 0.82 | SMPD3 (0.53) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL2411298 | 0.81 | SMPD3 (0.51) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL1912050 | 0.79 | CRHBP (0.53) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL31052606 | 0.79 | MAPT (0.53) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL16908180 | 0.79 | SMPD3 (0.50) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| Hydrochloric Acid SCHEMBL16741039 | 0.78 | GAA (0.55) | MAPTCYP1A2CYP2D6CRHBPCRHR2 | |
| Hydrochloric Acid SCHEMBL16742804 | 0.78 | GAA (0.55) | MAPTCYP1A2CYP2D6CRHBPCRHR2 | |
| Hydrochloric Acid SCHEMBL31052704 | 0.78 | MAPT (0.51) | MAPTCYP1A2CYP2D6SMPD3CRHBP | |
| SCHEMBL2416637 | 0.76 | SMPD3 (0.47) | MAPTCYP1A2CYP2D6SMPD3CRHBP |
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-2007097697-A1 | THERAPEUTIC QUINOLINE COMPOUNDS THAT ARE 5HT1B MODULATORS | ASTRAZENECA AB (SE) | 2007-08-30 | — | — | WO | disclosed |