Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
| ▸ | PARP1 | P09874 | 9/20 | 0.35 |
| ▸ | ITGB3 | P05106 | 3/20 | 0.35 |
| ▸ | ITGA2B | P08514 | 3/20 | 0.35 |
| ▸ | NAMPT | P43490 | 1/20 | 0.35 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7410717 | 0.75 | PARP1 (0.39) | PARP1 | |
| SCHEMBL7417447 | 0.74 | PIM1 (0.45) | HTR3APARP1PIM1 | |
| SCHEMBL7417446 | 0.74 | HTR3A (0.40) | HTR3APARP1ITGB3ITGA2BNAMPT | |
| SCHEMBL7415905 | 0.74 | PARP1 (0.50) | PARP1 | |
| SCHEMBL20458912 | 0.73 | HTR3A (0.44) | HTR3APARP1ITGB3ITGA2BNAMPT | |
| SCHEMBL7411210 | 0.72 | PARP1 (0.37) | PARP1 | |
| SCHEMBL7409889 | 0.72 | PARP1 (0.50) | PARP1PIM1 | |
| SCHEMBL7415578 | 0.71 | PIM1 (0.40) | HTR3APARP1ITGB3ITGA2BPIM1 | |
| SCHEMBL20449682 | 0.69 | PARP1 (0.56) | HTR3APARP1KDM4E | |
| SCHEMBL17697629 | 0.68 | CRBN (0.59) | HTR3APARP1KDM4EMEN1KMT2A |
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-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 |