Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.36 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MGAM | O43451 | 1/20 | 0.35 |
| ▸ | SI | P14410 | 1/20 | 0.35 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.35 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL6805077 | 0.86 | PARP1 (0.58) | PARP1TSHR | |
| SCHEMBL6805083 | 0.75 | TSHR (0.48) | PARP1TSHRPTGDR2GRM2SMN1; SMN2 | |
| SCHEMBL7763612 | 0.74 | PARP1 (0.41) | PARP1GAALMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL6585205 | 0.74 | PARP1 (0.42) | PARP1GRM2GAALMNASMN1; SMN2 | |
| SCHEMBL6591596 | 0.73 | PARP1 (0.48) | PARP1GAAMGAMSIMGAM2 | |
| SCHEMBL6591702 | 0.72 | PARP1 (0.44) | PARP1GAALMNASMN1; SMN2L3MBTL1 | |
| SCHEMBL6384512 | 0.71 | PARP1 (0.56) | PARP1 | |
| SCHEMBL6383679 | 0.71 | PARP1 (0.72) | PARP1 | |
| SCHEMBL6587289 | 0.70 | PARP1 (0.49) | PARP1GAAMGAMSIMGAM2 | |
| SCHEMBL6381152 | 0.70 | PARP1 (0.73) | PARP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1177178-B1 | HETEROCYCLICALLY SUBSTITUTED BENZIMIDAZOLES, THE PRODUCTION AND APPLICATION THEREOF | ABBOTT GMBH & CO KG (DE) | 2004-12-29 | — | — | EP | disclosed |