Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A2 | P23975 | 2/20 | 0.63 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.63 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.63 |
| ▸ | HTR2A | P28223 | 1/20 | 0.63 |
| ▸ | HRH1 | P35367 | 1/20 | 0.63 |
| ▸ | HTR2B | P41595 | 1/20 | 0.63 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.63 |
| ▸ | TAAR1 | Q96RJ0 | 2/20 | 0.52 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.45 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.42 |
| ▸ | HTR3B | O95264 | 1/20 | 0.42 |
| ▸ | HTR3A | P46098 | 1/20 | 0.42 |
| ▸ | HTR3D | Q70Z44 | 1/20 | 0.42 |
| ▸ | HTR3C | Q8WXA8 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | IDO1 | P14902 | 6/20 | 0.40 |
| ▸ | AGXT | P21549 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL21058265 | 0.89 | SLC6A2 (0.44) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL9917313 | 0.82 | TAAR1 (0.50) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL11131886 | 0.80 | GFER (0.56) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL9427612 | 0.80 | CYP1A2 (0.54) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL25341473 | 0.78 | ALDH1A1 (0.49) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL21058254 | 0.78 | TAAR1 (0.52) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL9521673 | 0.78 | TAAR1 (0.47) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL21058268 | 0.78 | CYP3A4 (0.40) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 | |
| SCHEMBL11134725 | 0.78 | ESR1 (0.54) | SLC6A2SLC6A3SLC6A4TAAR1HTR3A | |
| SCHEMBL11462574 | 0.78 | ALDH1A1 (0.49) | SLC6A2SLC6A3SLC6A4HTR2AHRH1 |
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-2262784-A1 | INHIBITORS OF THE CHEMOKINE RECEPTOR CXCR3 | Sanofi-Aventis (FR) | 2010-12-22 | — | — | EP | disclosed |
| WO-2009105435-A1 | INHIBITORS OF THE CHEMOKINE RECEPTOR CXCR3 | SANOFI-AVENTIS (FR) | 2009-08-27 | — | — | WO | disclosed |