Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.43 |
| ▸ | PARP1 | P09874 | 3/20 | 0.42 |
| ▸ | KIT | P10721 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 3/20 | 0.41 |
| ▸ | AURKA | O14965 | 2/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.41 |
| ▸ | CDK2 | P24941 | 2/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 2/20 | 0.41 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.40 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | GPR84 | Q9NQS5 | 3/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4902772 | 0.71 | PDPK1 (0.43) | HPGDALDH1A1HSD17B10L3MBTL1PARP1 | |
| SCHEMBL26964466 | 0.71 | KIT (0.42) | HPGDALDH1A1HSD17B10L3MBTL1GRIN2B | |
| SCHEMBL22235844 | 0.71 | KIT (0.48) | PARP1KITCDK1AURKACCNB1 | |
| SCHEMBL7444669 | 0.70 | PARP1 (0.57) | HPGDALDH1A1HSD17B10L3MBTL1GRIN2B | |
| SCHEMBL16229465 | 0.70 | AURKA (0.48) | HPGDALDH1A1HSD17B10PARP1KIT | |
| SCHEMBL5287220 | 0.70 | FGFR1 (0.52) | HPGDALDH1A1HSD17B10L3MBTL1PARP1 | |
| SCHEMBL546253 | 0.69 | FGFR1 (0.45) | HPGDALDH1A1HSD17B10L3MBTL1PARP1 | |
| SCHEMBL8262963 | 0.69 | FGFR1 (0.51) | HPGDALDH1A1HSD17B10L3MBTL1PARP1 | |
| SCHEMBL3539733 | 0.69 | NCF1 (0.47) | HPGDALDH1A1PARP1KDM4ENPC1 | |
| SCHEMBL110204 | 0.69 | CDK1 (0.44) | HPGDALDH1A1HSD17B10L3MBTL1GRIN2B |
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-2424843-A1 | IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES | Novartis AG (CH) | 2012-03-07 | — | — | EP | disclosed |
| WO-2010125402-A1 | IMIDAZOLE DERIVATIVES AND THEIR USE AS MODULATORS OF CYCLIN DEPENDENT KINASES | NOVARTIS AG (CH) | 2010-11-04 | — | — | WO | disclosed |