Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.36 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.36 |
| ▸ | AKR1A1 | P14550 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | HTR2A | P28223 | 1/20 | 0.35 |
| ▸ | HTR2C | P28335 | 1/20 | 0.35 |
| ▸ | HRH1 | P35367 | 1/20 | 0.35 |
| ▸ | DRD3 | P35462 | 1/20 | 0.35 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.35 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.35 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1237496 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL1237494 | 0.80 | ALDH1A1 (0.50) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL29956302 | 0.77 | ALDH1A1 (0.35) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL31072283 | 0.77 | CPT2 (0.41) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL940318 | 0.77 | CPT2 (0.41) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL23071625 | 0.77 | CPT2 (0.41) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL42928 | 0.77 | CPT2 (0.41) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL940317 | 0.77 | CPT2 (0.41) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL3640221 | 0.76 | CHRM1 (0.36) | ALDH1A1TSHRCHRM1ADRA1AHMGCR | |
| SCHEMBL8668420 | 0.76 | CHRM1 (0.36) | ALDH1A1TSHRCHRM1ADRA1AHMGCR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1871855-B1 | DIHYDROXY ENOL COMPOUNDS USED IN CHEMICAL MECHANICAL POLISHING COMPOSITIONS HAVING METAL ION OXIDIZERS | DUPONT AIR PROD NANOMATERIALS (US) | 2010-03-24 | — | — | EP | claimed |