Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSTP1 | P09211 | 2/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL2853089 | 0.92 | GSTP1 (0.32) | GSTP1 | |
| SCHEMBL2849017 | 0.85 | GSTP1 (0.42) | GSTP1 | |
| SCHEMBL2851460 | 0.78 | ALDH1A1 (0.37) | GSTP1 | |
| SCHEMBL2850974 | 0.76 | GSTP1 (0.33) | GSTP1NPC1 | |
| SCHEMBL2849068 | 0.71 | THRB (0.40) | — | |
| SCHEMBL2853278 | 0.70 | ALDH1A1 (0.39) | — | |
| SCHEMBL2878633 | 0.70 | SYK (0.37) | GSTP1 | |
| SCHEMBL22641245 | 0.68 | PTGS2 (0.48) | NPC1POLBRAB9A | |
| SCHEMBL743966 | 0.67 | — | — | |
| SCHEMBL4631483 | 0.67 | PTGS2 (0.34) | NPC1POLBRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1924558-B1 | AN ANTIMALARIAL BAYLIS-HILLMAN ADDUCTS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2010-01-13 | — | — | EP | claimed |
| EP-1924558-B1 | AN ANTIMALARIAL BAYLIS-HILLMAN ADDUCTS AND A PROCESS FOR THE PREPARATION THEREOF | COUNCIL SCIENT IND RES (IN) | 2010-01-13 | — | — | EP | disclosed |