Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.39 |
| ▸ | ADRB1 | P08588 | 1/20 | 0.39 |
| ▸ | HTR1A | P08908 | 1/20 | 0.39 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.39 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.39 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.39 |
| ▸ | HTR2C | P28335 | 1/20 | 0.39 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.39 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.39 |
| ▸ | DRD3 | P35462 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | SLC6A3 | Q01959 | 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 | |
|---|---|---|---|---|
| SCHEMBL15032871 | 0.81 | MAPK1 (0.42) | USP2CYP3A4NR1I2ADRB1HTR1A | |
| SCHEMBL9835578 | 0.77 | ALDH1A1 (0.39) | ALDH1A1POLBTSHRHPGD | |
| SCHEMBL8563484 | 0.76 | MMP8 (0.46) | CYP1A2MMP8EPHX2PPARGALDH1A1 | |
| SCHEMBL12311754 | 0.75 | MMP8 (0.59) | CYP3A4CYP2C9MMP8EPHX2PPARG | |
| SCHEMBL1892061 | 0.75 | MMP8 (0.59) | CYP3A4CYP2C9MMP8EPHX2PPARG | |
| Bicarbonate SCHEMBL27963012 | 0.73 | MMP8 (0.58) | CYP3A4CYP2C9MMP8EPHX2PPARG | |
| Phosphine SCHEMBL27538208 | 0.73 | MMP8 (0.58) | CYP3A4CYP2C9MMP8EPHX2PPARG | |
| SCHEMBL9837994 | 0.72 | MAPT (0.36) | ALDH1A1TP53L3MBTL1LMNAPOLB | |
| SCHEMBL20254521 | 0.72 | MMP8 (0.43) | MMP8EPHX2PPARGALDH1A1TP53 | |
| SCHEMBL9632008 | 0.72 | ALDH1A1 (0.51) | MMP8EPHX2PPARGALDH1A1TP53 |
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-0219308-B1 | 2-SUBSTITUTED QUINOLINES | MERCK FROSST CANADA INC. (CA) | 1991-10-23 | — | — | EP | disclosed |