Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 3/20 | 0.54 |
| ▸ | CA9 | Q16790 | 5/20 | 0.50 |
| ▸ | CA12 | O43570 | 4/20 | 0.50 |
| ▸ | CA1 | P00915 | 4/20 | 0.50 |
| ▸ | CA2 | P00918 | 4/20 | 0.50 |
| ▸ | GABRA1 | P14867 | 2/20 | 0.50 |
| ▸ | GABRB2 | P47870 | 2/20 | 0.50 |
| ▸ | NSD2 | O96028 | 1/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | PLCG1 | P19174 | 1/20 | 0.50 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.50 |
| ▸ | CASP6 | P55212 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | CA4 | P22748 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | XDH | P47989 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7699059 | 0.89 | GABRA1 (0.55) | GPR35CA9CA12CA1CA2 | |
| SCHEMBL28539274 | 0.81 | GABRA1 (0.50) | GPR35CA9CA12CA1CA2 | |
| SCHEMBL28001850 | 0.81 | GABRA1 (0.50) | GPR35GABRA1GABRB2CASP6L3MBTL1 | |
| SCHEMBL10729189 | 0.78 | GABRA1 (0.65) | GABRA1GABRB2ALDH1A1CYP3A4 | |
| SCHEMBL8307443 | 0.78 | TDP1 (0.53) | GABRA1GABRB2GAAALDH1A1CYP3A4 | |
| SCHEMBL27827311 | 0.76 | GPR35 (0.56) | GPR35CA9CA12CA1CA2 | |
| SCHEMBL5706543 | 0.76 | CA9 (0.59) | GPR35CA9CA12CA1CA2 | |
| SCHEMBL25337785 | 0.76 | TNKS (0.65) | GABRA1GABRB2GAAALDH1A1CYP3A4 | |
| SCHEMBL29519288 | 0.76 | TNKS (0.65) | GABRA1GABRB2GAAALDH1A1CYP3A4 | |
| SCHEMBL8733637 | 0.74 | XDH (0.58) | GPR35CA9CA12CA1CA2 |
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-4322529-A | Tertiary-alkylamine salts of azine dyestuffs | CIBA-GEIGY CORPORATION (US) | 1982-03-30 | — | — | US | disclosed |
| US-3994872-A | SOLUBILITY | CIBA-GEIGY CORPORATION (US) | 1976-11-30 | — | — | US | disclosed |