Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM1 | P11229 | 1/20 | 0.40 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.40 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | HTR2C | P28335 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | DRD3 | P35462 | 1/20 | 0.40 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 4/20 | 0.39 |
| ▸ | CA1 | P00915 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | CA2 | P00918 | 1/20 | 0.38 |
| ▸ | METAP1 | P53582 | 2/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Bicarbonate SCHEMBL7424110 | 0.80 | HDAC1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Bicarbonate SCHEMBL9490608 | 0.80 | HDAC1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Bicarbonate SCHEMBL14245001 | 0.80 | HDAC1 (0.52) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Acetone SCHEMBL290188 | 0.80 | TDP1 (0.46) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| SCHEMBL28099881 | 0.80 | CHRM1 (0.37) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Propionamide SCHEMBL27818002 | 0.80 | — | — | |
| Bicarbonate SCHEMBL28420339 | 0.78 | CHRM1 (0.50) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Acetic Acid SCHEMBL2827965 | 0.78 | TDP1 (0.50) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Thiourea SCHEMBL9443298 | 0.78 | TSHR (0.39) | CHRM1AKR1A1CHRM3HTR2AHTR2C | |
| Hydrogen Peroxide SCHEMBL18614730 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2325213-B1 | CATALYST FOR LIVING RADICAL POLYMERIZATION | UNIV KYOTO (JP) | 2013-01-02 | — | — | EP | disclosed |
| CN-101687939-B | Novel living radical polymerization method using phosphorus compound or nitrogen compound as catalyst | NAT UNIV CORP KYOTO UNIV | 2012-12-26 | — | — | CN | disclosed |
| CN-101687939-A | Novel living radical polymerization method using phosphorus compound or nitrogen compound as catalyst | UNIV KYOTO | 2010-03-31 | — | — | CN | disclosed |