Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRM2 | P08172 | 1/20 | 0.35 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.35 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.35 |
| ▸ | NR1H2 | P55055 | 1/20 | 0.33 |
| ▸ | PDK1 | Q15118 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL13885510 | 0.81 | NR1H2 (0.32) | NR1H2 | |
| SCHEMBL7979993 | 0.79 | CHRM2 (0.37) | CHRM2CHRM1CHRM3 | |
| SCHEMBL15469357 | 0.78 | NR1H2 (0.37) | NR1H2 | |
| SCHEMBL17884460 | 0.78 | NR1H2 (0.33) | NR1H2 | |
| SCHEMBL22403773 | 0.75 | NR1H2 (0.35) | NR1H2 | |
| SCHEMBL216412 | 0.74 | NR1H2 (0.56) | CHRM2CHRM1CHRM3NR1H2 | |
| SCHEMBL17733829 | 0.74 | SMN1; SMN2 (0.41) | NR1H2 | |
| SCHEMBL12204162 | 0.73 | HPGD (0.41) | — | |
| SCHEMBL16769197 | 0.72 | HPGD (0.36) | NR1H2 | |
| SCHEMBL13694454 | 0.72 | RECQL (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004071454-A2 | SUBSTITUTED AZETIDINE COMPOUNDS AS INHIBITORS OF DIPEPTIDYL PEPTIDASE IV | GUILFORD PHARMACEUTICALS INC. (US) | 2004-08-26 | — | — | WO | disclosed |