Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 4/20 | 0.40 |
| ▸ | NPY1R | P25929 | 1/20 | 0.38 |
| ▸ | OPRK1 | P41145 | 7/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.37 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.37 |
| ▸ | BRD4 | O60885 | 1/20 | 0.37 |
| ▸ | CREBBP | Q92793 | 1/20 | 0.37 |
| ▸ | CNR2 | P34972 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL7046613 | 0.99 | HTR3A (0.40) | HTR3ANPY1ROPRK1OPRM1OPRD1 | |
| SCHEMBL7046777 | 0.97 | HTR3A (0.39) | HTR3ANPY1ROPRK1OPRM1OPRD1 | |
| SCHEMBL7037841 | 0.96 | HTR3A (0.38) | HTR3ANPY1ROPRK1OPRM1OPRD1 | |
| SCHEMBL7042935 | 0.89 | HTR3A (0.42) | HTR3A | |
| SCHEMBL7042964 | 0.89 | HTR3A (0.42) | HTR3A | |
| SCHEMBL7044695 | 0.87 | HTR3A (0.40) | HTR3A | |
| SCHEMBL7036855 | 0.87 | HTR3A (0.40) | HTR3A | |
| SCHEMBL7043577 | 0.87 | ALDH1A1 (0.44) | CNR2 | |
| SCHEMBL7043438 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL7041296 | 0.86 | HTR3A (0.40) | HTR3A |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1133477-B1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | ABBOTT GMBH & CO KG (DE) | 2004-02-18 | — | — | EP | disclosed |
| EP-1133477-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2001-09-19 | — | — | EP | disclosed |
| WO-2000032579-A1 | SUBSTITUTED BENZIMIDAZOLES AND THEIR USE AS PARP INHIBITORS | BASF AKTIENGESELLSCHAFT (DE) | 2000-06-08 | — | — | WO | disclosed |