Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.49 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.49 |
| ▸ | TAAR1 | Q96RJ0 | 4/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | HTR2C | P28335 | 1/20 | 0.43 |
| ▸ | HMGCR | P04035 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL7090134 | 0.79 | TNKS2 (0.50) | HTR2ACYP19A1TAAR1CYP3A4HTR2C | |
| SCHEMBL900127 | 0.78 | HTR2A (0.52) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL28239353 | 0.77 | APLNR (0.56) | HTR2ACYP19A1TAAR1HTR2C | |
| SCHEMBL581243 | 0.76 | HTR2A (0.49) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL580350 | 0.76 | HTR2A (0.49) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL580817 | 0.76 | HTR2A (0.49) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL580783 | 0.76 | HTR2A (0.49) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL580254 | 0.76 | HTR2A (0.49) | HTR2ACYP19A1TAAR1CYP3A4HMGCR | |
| SCHEMBL24119648 | 0.76 | HTR2A (0.61) | HTR2ATAAR1HTR2CHMGCR | |
| SCHEMBL28748249 | 0.76 | HMGCR (0.67) | HTR2ACYP19A1TAAR1CYP3A4HTR2C |
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 |
|---|---|---|---|---|---|---|---|
| EP-2621922-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2013-08-07 | — | — | EP | disclosed |
| WO-2012041858-A1 | A PROCESS FOR THE SYNTHESIS OF THIO-TRIAZOLO-GROUP CONTAINING COMPOUNDS | BASF SE (DE) | 2012-04-05 | — | — | WO | disclosed |