Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GLB1 | P16278 | 1/20 | 0.37 |
| ▸ | DRD3 | P35462 | 5/20 | 0.36 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.35 |
| ▸ | EBP | Q15125 | 1/20 | 0.35 |
| ▸ | HTR1A | P08908 | 1/20 | 0.35 |
| ▸ | DRD2 | P14416 | 1/20 | 0.35 |
| ▸ | DRD1 | P21728 | 1/20 | 0.35 |
| ▸ | DRD4 | P21917 | 1/20 | 0.35 |
| ▸ | DRD5 | P21918 | 1/20 | 0.35 |
| ▸ | BCHE | P06276 | 3/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.33 |
| ▸ | GBA1 | P04062 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.33 |
| ▸ | HTR2A | P28223 | 1/20 | 0.33 |
| ▸ | SCN1A | P35498 | 1/20 | 0.33 |
| ▸ | HTR2B | P41595 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL6531628 | 0.95 | EBP (0.41) | DRD3SIGMAR1EBPHTR1ADRD2 | |
| SCHEMBL6506189 | 0.90 | DRD3 (0.44) | DRD3DRD2DRD1DRD4DRD5 | |
| SCHEMBL6509329 | 0.82 | DRD3 (0.38) | DRD3KCNH2HRH3 | |
| SCHEMBL14940771 | 0.79 | KDM4E (0.41) | DRD3MAPK1ALDH1A1 | |
| SCHEMBL7322831 | 0.79 | EBP (0.41) | DRD3SIGMAR1EBPHTR1ADRD2 | |
| SCHEMBL14940870 | 0.79 | SMN1; SMN2 (0.30) | DRD3 | |
| SCHEMBL14027741 | 0.75 | SIGMAR1 (0.52) | GLB1DRD3SIGMAR1EBPHTR1A | |
| SCHEMBL22463774 | 0.75 | SIGMAR1 (0.52) | GLB1DRD3SIGMAR1EBPHTR1A | |
| SCHEMBL29645051 | 0.75 | SIGMAR1 (0.52) | GLB1DRD3SIGMAR1EBPHTR1A | |
| SCHEMBL9935047 | 0.74 | EPHX1 (0.41) | GLB1DRD3SIGMAR1EBPHTR1A |
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-2005082892-A2 | TRIAZOLE COMPOUNDS AS ANTIBACTERIAL AGENTS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | DR. REDDY'S LABORATORIES LTD. (IN) | 2005-09-09 | — | — | WO | disclosed |