Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGS2 | P35354 | 2/20 | 0.31 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.30 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 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 | |
|---|---|---|---|---|
| SCHEMBL8582964 | 0.84 | PTGS2 (0.39) | PTGS2PTGS1MEN1ALDH1A1GAA | |
| SCHEMBL8579119 | 0.82 | CYP1A2 (0.40) | PTGS2PTGS1TDP1MEN1ALDH1A1 | |
| SCHEMBL8709022 | 0.81 | FABP4 (0.34) | MAPTMAPK1TDP1MEN1ALDH1A1 | |
| SCHEMBL8583282 | 0.77 | PTPN1 (0.33) | PTGS2 | |
| SCHEMBL8583061 | 0.73 | HSPA5 (0.32) | PTGS2MEN1ALDH1A1GAAKMT2A | |
| SCHEMBL8911876 | 0.72 | CA2 (0.39) | PTGS2PTGS1MAPTTDP1MEN1 | |
| SCHEMBL8708475 | 0.70 | PTGS2 (0.40) | PTGS2PTGS1MAPTTDP1MEN1 | |
| SCHEMBL8496737 | 0.70 | PTGS1 (0.40) | PTGS2PTGS1MAPTTDP1MEN1 | |
| SCHEMBL9159377 | 0.68 | GABBR2 (0.43) | PTGS2PTGS1MAPTMAPK1MEN1 | |
| SCHEMBL8306589 | 0.67 | PTGS2 (0.72) | PTGS2PTGS1MAPTMEN1ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-5731336-A | USING ARYL-SUBSTITUTED RHODAMINES | ELI LILLY AND COMPANY (US) | 1998-03-24 | — | — | US | disclosed |
| US-5716975-A | NONTOXIC RHODANINE DERIVATIVES; ANTIDIABETIC AGENTS, CATHEPSIN D INHIBITORS, B-AMYLOID PROTEIN REDUCTION | ELI LILLY AND COMPANY (US) | 1998-02-10 | — | — | US | disclosed |