Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1D | P28221 | 2/20 | 0.40 |
| ▸ | HTR1B | P28222 | 2/20 | 0.40 |
| ▸ | HTR2B | P41595 | 1/20 | 0.38 |
| ▸ | MTNR1A | P48039 | 4/20 | 0.36 |
| ▸ | MTNR1B | P49286 | 3/20 | 0.35 |
| ▸ | HTR1A | P08908 | 2/20 | 0.34 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.33 |
| ▸ | ELANE | P08246 | 5/20 | 0.32 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.32 |
| ▸ | PRKAB2 | O43741 | 1/20 | 0.31 |
| ▸ | PRKAG1 | P54619 | 1/20 | 0.31 |
| ▸ | PRKAA2 | P54646 | 1/20 | 0.31 |
| ▸ | PRKAA1 | Q13131 | 1/20 | 0.31 |
| ▸ | PRKAG3 | Q9UGI9 | 1/20 | 0.31 |
| ▸ | PRKAG2 | Q9UGJ0 | 1/20 | 0.31 |
| ▸ | PRKAB1 | Q9Y478 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL27584069 | 0.90 | HTR1D (0.39) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27779441 | 0.86 | HTR1D (0.40) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27491276 | 0.81 | IDO1 (0.36) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27584208 | 0.80 | EGFR (0.39) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27596759 | 0.78 | HTR1D (0.46) | HTR1DHTR1BELANESLC22A6 | |
| SCHEMBL27601675 | 0.78 | HTR1D (0.39) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27800478 | 0.76 | HTR1D (0.33) | HTR1DHTR1BELANE | |
| SCHEMBL27892284 | 0.73 | MTNR1A (0.41) | HTR1DHTR1BHTR2BMTNR1AMTNR1B | |
| SCHEMBL27800464 | 0.73 | ALDH1A1 (0.41) | HTR1DHTR1BMTNR1AMTNR1BELANE | |
| SCHEMBL27584061 | 0.73 | HTR1D (0.46) | HTR1DHTR1BELANESLC22A6 |
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 |
|---|---|---|---|---|---|---|---|
| CN-101691370-A | Triazolo[4,5-d] pyrimidine derivatives and their use as purinergic receptor antagonists | VERNALIS RES LTD | 2010-04-07 | — | — | CN | disclosed |