Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 1/20 | 0.37 |
| ▸ | HTR1B | P28222 | 1/20 | 0.37 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.36 |
| ▸ | PRKAB2 | O43741 | 6/20 | 0.36 |
| ▸ | PRKAG1 | P54619 | 6/20 | 0.36 |
| ▸ | PRKAA2 | P54646 | 6/20 | 0.36 |
| ▸ | PRKAA1 | Q13131 | 6/20 | 0.36 |
| ▸ | PRKAG3 | Q9UGI9 | 6/20 | 0.36 |
| ▸ | PRKAG2 | Q9UGJ0 | 6/20 | 0.36 |
| ▸ | PRKAB1 | Q9Y478 | 6/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | ELANE | P08246 | 2/20 | 0.35 |
| ▸ | MTNR1A | P48039 | 2/20 | 0.35 |
| ▸ | MTNR1B | P49286 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL27584208 | 0.83 | EGFR (0.39) | HTR1DHTR1BSLC22A6PRKAB2PRKAG1 | |
| SCHEMBL27601675 | 0.82 | HTR1D (0.39) | HTR1DHTR1BSLC22A6PRKAB2PRKAG1 | |
| SCHEMBL27779441 | 0.80 | HTR1D (0.40) | HTR1DHTR1BSLC22A6PRKAB2PRKAG1 | |
| SCHEMBL27591784 | 0.79 | NR4A2 (0.52) | HTR1DHTR1BSLC22A6ELANESLC6A4 | |
| SCHEMBL27591862 | 0.79 | NR4A2 (0.52) | HTR1DHTR1BSLC22A6MTNR1AMTNR1B | |
| SCHEMBL26972869 | 0.76 | ELANE (0.46) | MAPTELANELMNACYP3A4HIF1A | |
| SCHEMBL27601872 | 0.75 | MAPT (0.39) | HTR1DHTR1BMAPTELANELMNA | |
| SCHEMBL27584062 | 0.75 | MAPT (0.36) | HTR1DHTR1BMAPTELANELMNA | |
| SCHEMBL28000737 | 0.73 | HTR1D (0.45) | HTR1DHTR1BSLC22A6ELANECYP1A2 | |
| SCHEMBL28312447 | 0.73 | CYP2A6 (0.44) | HTR1DHTR1BSLC22A6ELANENR4A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101214248-A | Triazolo[4,5-d] pyrimidine derivatives and their application as purinergic receptor antagonists | VERNALIS RES LTD (GB) | 2008-07-09 | — | — | CN | disclosed |
| CN-1496262-A | Triazolo [4, 5-d ] pyrimidine derivatives and their use as purinergic receptor antagonists | О | 2004-05-12 | — | — | CN | disclosed |