Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.62 |
| ▸ | GRM5 | P41594 | 6/20 | 0.60 |
| ▸ | IDO1 | P14902 | 2/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | USP2 | O75604 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | KDM1A | O60341 | 1/20 | 0.48 |
| ▸ | XDH | P47989 | 1/20 | 0.48 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.47 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.47 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.47 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.47 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL17116600 | 0.91 | CLK4 (0.51) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL10389736 | 0.87 | CLK4 (0.59) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL30158989 | 0.87 | ASIC3 (0.53) | CLK4GRM5CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL2949191 | 0.87 | ASIC3 (0.53) | CLK4GRM5CYP1A2CYP2C19HSD17B10 | |
| SCHEMBL21141650 | 0.86 | CLK4 (0.56) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL17116715 | 0.86 | CLK4 (0.56) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL15344138 | 0.86 | CLK4 (0.56) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL17116421 | 0.85 | CYP11B1 (0.54) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL17116058 | 0.85 | GRM5 (0.47) | CLK4GRM5IDO1CYP1A2CYP2C19 | |
| SCHEMBL16016610 | 0.84 | GABRG2 (0.63) | CLK4GRM5CYP1A2CYP2C19HSD17B10 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5064832-A | Bipyrimidine Compounds, Antitumor Agents | CIBA-GEIGY CORPORATION (US) | 1991-11-12 | — | — | US | disclosed |
| US-4968804-A | Bipyridine compounds | CIBA-GEIGY CORPORATION (US) | 1990-11-06 | — | — | US | disclosed |
| EP-0350448-A1 | Biaryl compounds | CIBA-GEIGY AG (CH) | 1990-01-10 | — | — | EP | disclosed |