Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 1/20 | 0.40 |
| ▸ | CA2 | P00918 | 1/20 | 0.40 |
| ▸ | GPR3 | P46089 | 5/20 | 0.40 |
| ▸ | HTR1D | P28221 | 5/20 | 0.39 |
| ▸ | HTR1A | P08908 | 4/20 | 0.39 |
| ▸ | HTR1B | P28222 | 4/20 | 0.39 |
| ▸ | HSD11B1 | P28845 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 1/20 | 0.37 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.36 |
| ▸ | CXCR2 | P25025 | 2/20 | 0.35 |
| ▸ | DRD2 | P14416 | 2/20 | 0.35 |
| ▸ | DRD3 | P35462 | 2/20 | 0.35 |
| ▸ | CXCR1 | P25024 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.34 |
| ▸ | DRD4 | P21917 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL3688422 | 0.78 | CA1 (0.44) | CA1CA2HTR1DHTR1AHTR1B | |
| SCHEMBL6937967 | 0.77 | KIF11 (0.47) | CA1CA2CES1CXCR2CXCR1 | |
| SCHEMBL4056753 | 0.75 | CA1 (0.51) | CA1CA2HTR1DHTR1AHTR1B | |
| SCHEMBL6941025 | 0.75 | CA1 (0.47) | CA1CA2DRD2DRD3DRD4 | |
| SCHEMBL31669018 | 0.75 | CHRM1 (0.43) | CA1CA2GPR3HTR1DHTR1A | |
| SCHEMBL576035 | 0.74 | CA2 (0.50) | CA1CA2HTR1DHTR1AHTR1B | |
| SCHEMBL8501949 | 0.74 | CA1 (0.53) | CA1CA2HTR1DHTR1AHTR1B | |
| Hydrogen Sulfide SCHEMBL9013053 | 0.73 | HSD11B1 (0.39) | CA1CA2HTR1DHTR1AHTR1B | |
| SCHEMBL17396312 | 0.73 | ALDH1A1 (0.47) | — | |
| SCHEMBL16396491 | 0.73 | RXRA (0.43) | HTR1DDRD2DRD3DRD4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0813560-A2 | SOLUBLE FLUORINATED POLY-P-PHENYLENES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1997-12-29 | — | — | EP | disclosed |
| WO-1996028491-A1 | SOLUBLE FLUORINATED POLY-P-PHENYLENES | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1996-09-19 | — | — | WO | disclosed |