Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | IDO1 | P14902 | 1/20 | 0.42 |
| ▸ | TDO2 | P48775 | 1/20 | 0.42 |
| ▸ | NR1H2 | P55055 | 2/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | TNKS2 | Q9H2K2 | 1/20 | 0.40 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.40 |
| ▸ | MKNK1 | Q9BUB5 | 3/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | ADORA1 | P30542 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 5/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.38 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.37 |
| ▸ | CRBN | Q96SW2 | 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 | |
|---|---|---|---|---|
| SCHEMBL2488053 | 0.84 | GLS (0.44) | IDO1TDO2PARP1TNKS2PARP2 | |
| SCHEMBL2487774 | 0.83 | CKS1B (0.47) | PARP1TNKS2PARP2HDAC1HDAC6 | |
| SCHEMBL2490202 | 0.80 | PARP1 (0.43) | PARP1TNKS2PARP2ACACBHDAC1 | |
| SCHEMBL2486452 | 0.80 | NR1H2 (0.51) | IDO1TDO2NR1H2PARP1TNKS2 | |
| SCHEMBL2485090 | 0.77 | MAP2K4 (0.43) | NR1H2PARP1TNKS2PARP2HDAC1 | |
| SCHEMBL2488516 | 0.76 | BTK (0.40) | PARP1TNKS2PARP2MKNK1 | |
| SCHEMBL2486666 | 0.75 | NPC1 (0.47) | MAPT | |
| SCHEMBL2484169 | 0.75 | ROCK2 (0.46) | IDO1TDO2PARP1TNKS2PARP2 | |
| SCHEMBL19643783 | 0.74 | ADORA1 (0.44) | NR1H2PARP1TNKS2PARP2MKNK1 | |
| SCHEMBL26703719 | 0.72 | NR1H2 (0.52) | NR1H2PARP1TNKS2PARP2MAPT |
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-2379551-A1 | SUBSTITUTED PYRAZOLO [3, 4-B]PYRIDINE COMPOUNDS | ArQule, Inc. (US) | 2011-10-26 | — | — | EP | disclosed |
| WO-2010078427-A1 | SUBSTITUTED PYRAZOLO [3, 4-B] PYRIDINE COMPOUNDS | ARQULE, INC. (US) | 2010-07-08 | — | — | WO | disclosed |