Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 2/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.53 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.53 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.53 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.53 |
| ▸ | HTR2A | P28223 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.53 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.53 |
| ▸ | HRH1 | P35367 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
| ▸ | SLC1A2 | P43004 | 3/20 | 0.40 |
| ▸ | SLC1A1 | P43005 | 3/20 | 0.40 |
| ▸ | GRIK1 | P39086 | 3/20 | 0.40 |
| ▸ | GRIK2 | Q13002 | 3/20 | 0.40 |
| ▸ | SLC1A3 | P43003 | 2/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16928457 | 0.88 | CA2 (0.48) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL16798436 | 0.82 | SLC1A2 (0.40) | SLC1A2SLC1A1GRIK1GRIK2SLC1A3 | |
| SCHEMBL16859227 | 0.81 | MEN1 (0.30) | CA2MAPK1MEN1GAAKMT2A | |
| SCHEMBL20954689 | 0.79 | CHRM1 (0.44) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL3179292 | 0.77 | TET2 (0.38) | SMN1; SMN2 | |
| SCHEMBL3179303 | 0.77 | TET2 (0.38) | SMN1; SMN2 | |
| SCHEMBL12858172 | 0.77 | GABRR1 (0.41) | — | |
| SCHEMBL29281205 | 0.77 | CA2 (0.41) | HDAC1HDAC2CHRM1AKR1A1CHRM3 | |
| SCHEMBL490891 | 0.76 | NOS3 (0.41) | SLC1A2SLC1A1GRIK1GRIK2SLC1A3 | |
| SCHEMBL2644569 | 0.76 | MAPT (0.39) | — |
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-5081152-A | AZULENE DERIVATIVES AS THROMBOXANE A2 AND PROSTAGLANDIN ENDOPEROXIDE RECEPTOR ANTAGONIST | KOTOBUKI SEIYAKU CO., LTD. (JP) | 1992-01-14 | — | — | US | disclosed |