Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.56 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.54 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | SLC5A1 | P13866 | 1/20 | 0.48 |
| ▸ | SLC5A2 | P31639 | 1/20 | 0.48 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 8/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.47 |
| ▸ | FLT3 | P36888 | 1/20 | 0.47 |
| ▸ | PPARA | Q07869 | 1/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 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 | |
|---|---|---|---|---|
| SCHEMBL9115147 | 0.96 | ABCG2 (0.56) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9111571 | 0.92 | MAPT (0.57) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9115180 | 0.91 | ABCG2 (0.66) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9110923 | 0.89 | MAPT (0.63) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112530 | 0.89 | ABCG2 (0.63) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9114466 | 0.88 | KDM4E (0.58) | ABCG2KDM4ELMNAMAPTALDH1A1 | |
| SCHEMBL9113397 | 0.88 | ABCG2 (0.56) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112362 | 0.88 | ABCG2 (0.49) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112502 | 0.87 | SLC5A1 (0.50) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112030 | 0.87 | MAOB (0.59) | ABCG2CYP1A1CYP1B1KDM4ELMNA |
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 |