Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TNKS | O95271 | 7/20 | 0.53 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 6/20 | 0.41 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.41 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.41 |
| ▸ | TNKS2 | Q9H2K2 | 2/20 | 0.41 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.38 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.37 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.37 |
| ▸ | KDR | P35968 | 1/20 | 0.37 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.37 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.37 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.37 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.37 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.37 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.37 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.37 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.37 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.37 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL16625238 | 0.78 | TNKS (0.74) | TNKSRIPK1PARP1TNKS2 | |
| SCHEMBL16625250 | 0.75 | TNKS (0.52) | TNKSPARP1 | |
| SCHEMBL16625259 | 0.74 | TNKS (0.47) | TNKSPARP1TNKS2 | |
| SCHEMBL16625248 | 0.74 | TNKS (0.54) | TNKSPARP1TNKS2 | |
| SCHEMBL16625240 | 0.74 | TNKS (0.61) | TNKSPARP1 | |
| SCHEMBL16625251 | 0.73 | TNKS (0.57) | TNKSPARP1TNKS2 | |
| SCHEMBL16625236 | 0.73 | MCHR1 (0.47) | TNKSPARP1TNKS2 | |
| SCHEMBL16625264 | 0.72 | TNKS (0.49) | TNKSPARP1PARP2TNKS2 | |
| SCHEMBL16625234 | 0.72 | TNKS (0.52) | TNKSPARP1PARP2TNKS2 | |
| SCHEMBL16625242 | 0.72 | TNKS (0.53) | TNKSPARP1TNKS2 |
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-2822656-B1 | 3-ARYL-5-SUBSTITUTED-ISOQUINOLIN-1-ONE COMPOUNDS AND THEIR THERAPEUTIC USE | CANCER RES INST ROYAL (GB) | 2016-10-19 | — | — | EP | disclosed |