Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRB3 | P13945 | 1/20 | 0.37 |
| ▸ | BCHE | P06276 | 2/20 | 0.35 |
| ▸ | HTR1B | P28222 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.33 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 2/20 | 0.33 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 2/20 | 0.32 |
| ▸ | HTR1D | P28221 | 2/20 | 0.32 |
| ▸ | HTR2C | P28335 | 2/20 | 0.32 |
| ▸ | HTR7 | P34969 | 2/20 | 0.32 |
| ▸ | HTR5A | P47898 | 2/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8603311 | 0.81 | HTR2A (0.46) | MAPTCYP1A2CYP2C9GAAALDH1A1 | |
| SCHEMBL593067 | 0.76 | BCHE (0.55) | BCHEMCHR1MAPTCYP1A2CYP2C9 | |
| SCHEMBL8601952 | 0.75 | ALDH1A1 (0.38) | MAPTCYP1A2GAAALDH1A1POLB | |
| SCHEMBL8602787 | 0.72 | MAPT (0.55) | MAPTCYP1A2GAAALDH1A1POLB | |
| SCHEMBL10602566 | 0.70 | MCHR1 (0.46) | MCHR1MAPTCYP1A2CYP2C9CYP2C19 | |
| SCHEMBL3794323 | 0.69 | HTR1B (0.55) | ADRB3HTR1BMAPTCYP1A2CYP2C9 | |
| SCHEMBL8604191 | 0.68 | GAA (0.35) | BCHEMAPTCYP1A2CYP2C19GAA | |
| SCHEMBL29148120 | 0.67 | KIF11 (0.53) | MAPTCYP1A2CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8808071 | 0.65 | KDM4E (0.52) | CYP1A2ALDH1A1CA1CA2HTT | |
| SCHEMBL15505899 | 0.65 | MCHR1 (0.36) | ADRB3MCHR1MAPTCYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| US-5773449-A | BACTERICIDES FOR HELICOBACTER | ZENYAKU KOGYO KABUSHIKI KAISHA (JP) | 1998-06-30 | — | — | US | disclosed |
| EP-0786454-A1 | THIOQUINOLONE DERIVATIVE | ZENYAKU KOGYO KABUSHIKIKAISHA (JP) | 1997-07-30 | — | — | EP | disclosed |