Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.33 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.32 |
| ▸ | ESR1 | P03372 | 1/20 | 0.32 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.32 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.31 |
| ▸ | ESRRG | P62508 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9726587 | 0.80 | TRPM8 (0.43) | ESR2RAB9ASMN1; SMN2 | |
| SCHEMBL9726796 | 0.77 | HMGCR (0.32) | AOC3RAB9ASMN1; SMN2PTGS2 | |
| SCHEMBL9726463 | 0.74 | HSD17B10 (0.39) | RAB9ASMN1; SMN2 | |
| SCHEMBL9726583 | 0.74 | SMN1; SMN2 (0.38) | RAB9ASMN1; SMN2 | |
| SCHEMBL9726494 | 0.74 | HMGCR (0.32) | AOC3 | |
| SCHEMBL9726501 | 0.74 | HMGCR (0.32) | AOC3 | |
| SCHEMBL9726990 | 0.73 | CES2 (0.40) | AOC3RAB9ASMN1; SMN2PTGS2 | |
| SCHEMBL10612239 | 0.69 | CYP1A2 (0.40) | RAB9ASMN1; SMN2 | |
| SCHEMBL10612229 | 0.69 | AOC3 (0.30) | AOC3 | |
| SCHEMBL9726535 | 0.68 | HMGCR (0.46) | ESR2RAB9ASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5110940-A | Inhibitors of 3-hydroxy-3-methylglutaryl coenzyme A reductase | BRISTOL-MYERS COMPANY (US) | 1992-05-05 | — | — | US | disclosed |
| US-5068346-A | Anticholesterol agents | BRISTOL-MYERS COMPANY (US) | 1991-11-26 | — | — | US | disclosed |
| US-4897490-A | DERIVATIVES OF BETA-HYDROXY,OMEGA-DIPHENYL,TETRAZOL-5-YL ALK-OMEGA-ENOIC ACID, ESTER OR LACTONE | BRISTOL-MEYERS COMPANY (US) | 1990-01-30 | — | — | US | disclosed |