Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 2/20 | 0.52 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.46 |
| ▸ | HTR2C | P28335 | 4/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.38 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.36 |
| ▸ | PSMB5 | P28074 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | HTR7 | P34969 | 1/20 | 0.35 |
| ▸ | CEL | P19835 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7650801 | 0.98 | CYP1A2 (0.50) | CYP1A2CYP2A6HTR2CALDH1A1DRD2 | |
| SCHEMBL10085450 | 0.92 | CYP1A2 (0.56) | CYP1A2CYP2A6HTR2CALDH1A1DRD2 | |
| SCHEMBL30449404 | 0.92 | CYP1A2 (0.56) | CYP1A2CYP2A6HTR2CALDH1A1DRD2 | |
| SCHEMBL25778265 | 0.90 | CYP1A2 (0.50) | CYP1A2CYP2A6HTR2CALDH1A1DRD2 | |
| SCHEMBL30735559 | 0.83 | HTR2C (0.62) | CYP1A2HTR2CSLC6A4HTR6HTR1A | |
| SCHEMBL19284647 | 0.83 | HTR2C (0.62) | CYP1A2HTR2CSLC6A4HTR6HTR1A | |
| Hydrochloric Acid SCHEMBL19284627 | 0.82 | HTR2C (0.64) | CYP1A2HTR2CSLC6A4HTR6HTR1A | |
| SCHEMBL27751299 | 0.82 | PSMB5 (0.42) | CYP1A2CYP2A6HTR2CALDH1A1KDM4E | |
| SCHEMBL22953750 | 0.81 | CYP1A2 (0.41) | CYP1A2CYP2A6ALDH1A1 | |
| SCHEMBL13698238 | 0.77 | HTR2C (0.50) | CYP1A2HTR2CHTR6 |
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 |
|---|---|---|---|---|---|---|---|
| US-6492364-B1 | Triazolo and derivatives as chemokine inhibitors | TORAY INDUSTRIES, INC. (JP) | 2002-12-10 | — | — | US | disclosed |
| EP-1067130-A1 | TRIAZOLO DERIVATIVES AND CHEMOKINE INHIBITORS CONTAINING THE SAME AS THE ACTIVE INGREDIENT | TORAY INDUSTRIES, INC. (JP) | 2001-01-10 | — | — | EP | disclosed |