Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 12/20 | 0.56 |
| ▸ | PARP10 | Q53GL7 | 7/20 | 0.56 |
| ▸ | PARP11 | Q9NR21 | 7/20 | 0.56 |
| ▸ | ACHE | P22303 | 1/20 | 0.45 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6922984 | 0.84 | PARP1 (0.58) | PARP1PARP10PARP11ACHE | |
| SCHEMBL27883759 | 0.76 | PARP1 (0.65) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL3002237 | 0.75 | PARP1 (0.63) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL30853838 | 0.75 | PARP1 (0.63) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL29688148 | 0.75 | PARP1 (0.63) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL437787 | 0.75 | PARP1 (0.63) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL5073463 | 0.73 | PARP1 (0.64) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL831538 | 0.73 | PARP1 (1.00) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL29687894 | 0.73 | PARP1 (1.00) | PARP1PARP10PARP11ACHEPDPK1 | |
| SCHEMBL830807 | 0.73 | PARP1 (1.00) | PARP1PARP10PARP11ACHEPDPK1 |
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-2011009484-A1 | ARYLPYRAZOLES AND ARYLISOXAZOLES AND THEIR USE AS PKD MODULATORS | NOVARTIS AG (CH) | 2011-01-27 | — | — | WO | disclosed |