Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.64 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.59 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.57 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.57 |
| ▸ | BCHE | P06276 | 8/20 | 0.57 |
| ▸ | ACHE | P22303 | 6/20 | 0.56 |
| ▸ | MAOB | P27338 | 1/20 | 0.53 |
| ▸ | DPP4 | P27487 | 3/20 | 0.53 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.53 |
| ▸ | EGFR | P00533 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL9112373 | 0.97 | ABCG2 (0.67) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112638 | 0.93 | MAPT (0.67) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9115497 | 0.93 | MAPT (0.67) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112329 | 0.93 | ABCG2 (0.64) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112363 | 0.90 | KRAS (0.63) | ABCG2CYP1B1KDM4ELMNAMAPT | |
| SCHEMBL9111847 | 0.90 | KRAS (0.63) | ABCG2CYP1B1KDM4ELMNAMAPT | |
| SCHEMBL9114679 | 0.90 | KDM4E (0.67) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9112195 | 0.89 | ABCG2 (0.69) | ABCG2KDM4ELMNAMAPTALDH1A1 | |
| SCHEMBL9111894 | 0.89 | ABCG2 (0.56) | ABCG2CYP1A1CYP1B1KDM4ELMNA | |
| SCHEMBL9113397 | 0.89 | ABCG2 (0.56) | 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 1 patent. 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 |