Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 6/20 | 0.58 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.53 |
| ▸ | CES2 | O00748 | 4/20 | 0.50 |
| ▸ | CES1 | P23141 | 4/20 | 0.50 |
| ▸ | ESR2 | Q92731 | 3/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 2/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | ATM | Q13315 | 1/20 | 0.40 |
| ▸ | PSMB1 | P20618 | 1/20 | 0.40 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.40 |
| ▸ | PSMB2 | P49721 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4326009 | 0.88 | ESR1 (0.64) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL11125618 | 0.85 | PTGS2 (0.63) | ESR1PTGS2CES2CES1LMNA | |
| SCHEMBL9317931 | 0.84 | ESR1 (0.56) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL29822148 | 0.84 | PTGS2 (0.61) | ESR1PTGS2CES2CES1 | |
| SCHEMBL7712232 | 0.82 | PTGS2 (0.44) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL9310063 | 0.82 | ESR1 (0.58) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL8615209 | 0.82 | ESR1 (0.81) | ESR1PTGS2ESR2CYP19A1PSMB1 | |
| SCHEMBL9310985 | 0.81 | ESR1 (0.55) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL12174192 | 0.80 | LMNA (0.45) | ESR1PTGS2CES2CES1ESR2 | |
| SCHEMBL9310269 | 0.80 | ESR1 (0.56) | ESR1PTGS2CES2CES1ESR2 |
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-5326489-A | Sulfonated polymer | NIPPON SHOKUBAI CO., LTD. (JP) | 1994-07-05 | — | — | US | disclosed |
| EP-0523300-B1 | Electrorheological fluids | NIPPON CATALYTIC CHEM IND (JP) | 1994-01-19 | — | — | EP | disclosed |
| EP-0523300-A1 | Electrorheological fluids | NIPPON SHOKUBAI KAGAKU KOGYO CO. LTD. (JP) | 1993-01-20 | — | — | EP | disclosed |