Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.57 |
| ▸ | PTPN1 | P18031 | 10/20 | 0.51 |
| ▸ | DPP4 | P27487 | 3/20 | 0.51 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.46 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL9110716 | 0.95 | ABCG2 (0.56) | ABCG2PTPN1DPP4CYP1A1CYP1B1 | |
| SCHEMBL9114443 | 0.93 | PTPN1 (0.52) | ABCG2PTPN1DPP4CYP1A1CYP1B1 | |
| SCHEMBL9112615 | 0.92 | PTPN1 (0.56) | ABCG2PTPN1DPP4MAOBCYP1A1 | |
| SCHEMBL9115078 | 0.92 | PTPN1 (0.55) | ABCG2PTPN1DPP4CYP1A1CYP1B1 | |
| SCHEMBL9114919 | 0.91 | PTPN1 (0.56) | ABCG2PTPN1DPP4CYP1A1CYP1B1 | |
| SCHEMBL9115199 | 0.91 | DPP4 (0.53) | ABCG2PTPN1DPP4CYP1A1CYP1B1 | |
| SCHEMBL9114029 | 0.89 | PTPN1 (0.57) | ABCG2PTPN1DPP4MAOBCYP1A1 | |
| SCHEMBL9114026 | 0.89 | PTPN1 (0.57) | ABCG2PTPN1DPP4MAOBCYP1A1 | |
| SCHEMBL9112237 | 0.89 | ABCG2 (0.61) | ABCG2PTPN1DPP4MAOBCYP1A1 | |
| SCHEMBL9115138 | 0.88 | PTPN1 (0.55) | ABCG2PTPN1DPP4CYP1A1CYP1B1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1995006628-A1 | TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES OR BACTERIA | STATENS SERUMINSTITUT (DK) | 1995-03-09 | — | — | WO | claimed |
| WO-1995006628-A1 | TREATMENT AND PROPHYLAXIS OF DISEASES CAUSED BY PARASITES OR BACTERIA | STATENS SERUMINSTITUT (DK) | 1995-03-09 | — | — | WO | disclosed |