Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PLA2G2A | P14555 | 1/20 | 0.37 |
| ▸ | PPARG | P37231 | 3/20 | 0.37 |
| ▸ | PPARA | Q07869 | 3/20 | 0.37 |
| ▸ | GPR88 | Q9GZN0 | 2/20 | 0.37 |
| ▸ | PTGES | O14684 | 1/20 | 0.37 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.36 |
| ▸ | PPARD | Q03181 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | ITGB1 | P05556 | 2/20 | 0.35 |
| ▸ | ITGA4 | P13612 | 2/20 | 0.35 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.35 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9000714 | 0.95 | GPR88 (0.39) | PLA2G2AGPR88NPC1LMNATP53 | |
| SCHEMBL9000722 | 0.91 | SMN1; SMN2 (0.36) | GPR88NPC1LMNATP53MAPT | |
| SCHEMBL9000898 | 0.90 | EPHX1 (0.46) | NPC1TP53MAPTRAB9AEPHX1 | |
| SCHEMBL9000575 | 0.89 | SOAT1 (0.39) | MAPTSMN1; SMN2CYP2C19SOAT1 | |
| SCHEMBL9000713 | 0.87 | EPHX1 (0.43) | LMNAMAPTEPHX1SOAT1 | |
| SCHEMBL9000398 | 0.85 | EPHX1 (0.47) | NPC1LMNAMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL9000588 | 0.85 | EPHX1 (0.38) | LMNAEPHX1CYP2C19SOAT1 | |
| SCHEMBL9000603 | 0.85 | SOAT1 (0.35) | NPC1LMNAMAPTRAB9ASMN1; SMN2 | |
| SCHEMBL9000916 | 0.84 | SOAT1 (0.49) | SOAT1 | |
| SCHEMBL9000890 | 0.84 | SOAT1 (0.43) | NPC1LMNATP53MAPTRAB9A |
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 |
|---|---|---|---|---|---|---|---|
| US-5583147-A | INHIBITORS OF ACYL-COENZYME A: CHOLESTEROL O-TRANSFERASE; ANTIHYPERCHOLESTEROLEMIC AND/OR ANTIATHEROSCLEROTIC AGENTS | THE DUPONT MERCK PHARMACEUTICAL COMPANY (US) | 1996-12-10 | — | — | US | disclosed |