Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADORA2A | P29274 | 7/20 | 0.53 |
| ▸ | ADORA1 | P30542 | 4/20 | 0.53 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.36 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.36 |
| ▸ | AHCY | P23526 | 6/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | FGFR1 | P11362 | 1/20 | 0.33 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | PI4KA | P42356 | 1/20 | 0.33 |
| ▸ | PI4K2B | Q8TCG2 | 1/20 | 0.33 |
| ▸ | PI4K2A | Q9BTU6 | 1/20 | 0.33 |
| ▸ | PI4KB | Q9UBF8 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| 3-Propyladenine SCHEMBL15756434 | 0.83 | ADORA2A (0.53) | ADORA2AADORA1ADORA2BLMNAPI4KA | |
| SCHEMBL9108201 | 0.80 | ADORA2A (0.36) | ADORA2AADORA1ADORA2BAHCYLMNA | |
| SCHEMBL5513295 | 0.79 | ADORA2A (0.35) | ADORA2AADORA1ADORA2BAHCYLMNA | |
| 3-Ethyladenine SCHEMBL48200 | 0.79 | ADORA2A (0.50) | ADORA2AADORA1ADORA2BAHCYLMNA | |
| SCHEMBL31058427 | 0.76 | HSP90B1 (0.38) | ADORA2A | |
| SCHEMBL170695 | 0.75 | ADORA2A (0.41) | ADORA2AADORA1ADORA2BAHCYPI4KA | |
| SCHEMBL11076308 | 0.74 | AHCY (0.57) | ADORA2AADORA1ADORA2BAHCYPI4KA | |
| SCHEMBL13997084 | 0.73 | ADORA2A (0.43) | ADORA2AADORA1ADORA2BAHCYPI4KA | |
| SCHEMBL3520240 | 0.72 | SRC (0.38) | LMNAPI4KB | |
| 3-Benzyladenine SCHEMBL5352368 | 0.72 | ADORA2A (0.56) | ADORA2ALMNAPI4KAPI4K2BPI4K2A |
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 28 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103852548-B | Detecting method for 3-hydroxyethyl adenine (3-HOEtA) in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-06-24 | — | — | CN | claimed |
| CN-103823009-B | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-02-18 | — | — | CN | claimed |
| CN-103808836-B | Determination method of 3-alkylated adenine DNA adducts in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-01-07 | — | — | CN | claimed |
| CN-103822988-B | Application of LC (liquid chromatogram) tandem mass spectrum method in biological monitoring of N3-(2-hydroxyethyl)-adenine in large-scale smoker crowd samples | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-01-07 | — | — | CN | claimed |
| CN-103852548-A | Detecting method for 3-hydroxyethyl adenine (3-HOEtA) in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-06-11 | — | — | CN | claimed |
| CN-103823009-A | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | claimed |
| CN-103822988-A | Application of LC (liquid chromatogram) tandem mass spectrum method in biological monitoring of N3-(2-hydroxyethyl)-adenine in large-scale smoker crowd samples | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | claimed |
| CN-103808836-A | Determination method of 3-alkylated adenine DNA adducts in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-21 | — | — | CN | claimed |
| CN-103852548-B | Detecting method for 3-hydroxyethyl adenine (3-HOEtA) in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-06-24 | — | — | CN | disclosed |
| CN-103852548-B | Detecting method for 3-hydroxyethyl adenine (3-HOEtA) in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-06-24 | — | — | CN | disclosed |
| CN-103852548-B | Detecting method for 3-hydroxyethyl adenine (3-HOEtA) in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-06-24 | — | — | CN | disclosed |
| CN-103823009-B | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-02-18 | — | — | CN | disclosed |
| CN-103823009-B | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-02-18 | — | — | CN | disclosed |
| CN-103822988-B | Application of LC (liquid chromatogram) tandem mass spectrum method in biological monitoring of N3-(2-hydroxyethyl)-adenine in large-scale smoker crowd samples | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2015-01-07 | — | — | CN | disclosed |
| CN-103823009-A | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | disclosed |
| CN-103823009-A | Application of liquid chromatography tandem mass spectrogram method in biological monitoring of 3-alkylation adenine in mass smokers | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | disclosed |
| CN-103822988-A | Application of LC (liquid chromatogram) tandem mass spectrum method in biological monitoring of N3-(2-hydroxyethyl)-adenine in large-scale smoker crowd samples | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | disclosed |
| CN-103822988-A | Application of LC (liquid chromatogram) tandem mass spectrum method in biological monitoring of N3-(2-hydroxyethyl)-adenine in large-scale smoker crowd samples | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-28 | — | — | CN | disclosed |
| CN-103808836-A | Determination method of 3-alkylated adenine DNA adducts in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-21 | — | — | CN | disclosed |
| CN-103808836-A | Determination method of 3-alkylated adenine DNA adducts in urine | NAT TOBACCO QUALITY SUPERVISION & INSPECTION CT | 2014-05-21 | — | — | CN | disclosed |