Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GABBR2 | O75899 | 1/20 | 0.34 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.34 |
| ▸ | PTPN1 | P18031 | 4/20 | 0.33 |
| ▸ | EGFR | P00533 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | IDH1 | O75874 | 1/20 | 0.30 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.30 |
| ▸ | UGT1A1 | P22309 | 1/20 | 0.30 |
| ▸ | DPP4 | P27487 | 1/20 | 0.30 |
| ▸ | ABCC1 | P33527 | 1/20 | 0.30 |
| ▸ | PRMT6 | Q96LA8 | 1/20 | 0.30 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.30 |
| ▸ | MAOA | P21397 | 1/20 | 0.30 |
| ▸ | ACHE | P22303 | 1/20 | 0.30 |
| ▸ | MAOB | P27338 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5666377 | 1.00 | GABBR2 (0.34) | GABBR2GABBR1PTPN1EGFRCA1 | |
| SCHEMBL5662849 | 0.89 | TNFRSF1A (0.34) | PTPN1 | |
| SCHEMBL5665914 | 0.89 | GABBR2 (0.35) | GABBR2GABBR1PTPN1EGFRCA1 | |
| SCHEMBL6681383 | 0.89 | GABBR2 (0.35) | GABBR2GABBR1PTPN1EGFRCA1 | |
| SCHEMBL5665870 | 0.89 | HMGCR (0.38) | GABBR2GABBR1 | |
| SCHEMBL5665874 | 0.89 | HMGCR (0.38) | GABBR2GABBR1 | |
| SCHEMBL5669298 | 0.85 | GABBR2 (0.33) | GABBR2GABBR1PTPN1 | |
| SCHEMBL5669296 | 0.85 | GABBR2 (0.33) | GABBR2GABBR1PTPN1 | |
| SCHEMBL5669993 | 0.81 | GABBR2 (0.37) | GABBR2GABBR1 | |
| SCHEMBL5669996 | 0.81 | GABBR2 (0.37) | GABBR2GABBR1 |
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-2004026242-A2 | SUBSTITUTED KETOPHOSPHONATE INHIBITORS OF TUMOR CELL PROLIFERATION | ILEX ONCOLOGY RESEARCH, SARL (CH) | 2004-04-01 | — | — | WO | claimed |