Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHEK1 | O14757 | 7/20 | 0.45 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.43 |
| ▸ | CDK7 | P50613 | 3/20 | 0.42 |
| ▸ | PARP1 | P09874 | 1/20 | 0.40 |
| ▸ | AURKA | O14965 | 5/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 5/20 | 0.39 |
| ▸ | CDK1 | P06493 | 4/20 | 0.39 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.39 |
| ▸ | CDK2 | P24941 | 4/20 | 0.39 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.39 |
| ▸ | F9 | P00740 | 1/20 | 0.38 |
| ▸ | F10 | P00742 | 1/20 | 0.38 |
| ▸ | F11 | P03951 | 1/20 | 0.38 |
| ▸ | F7 | P08709 | 1/20 | 0.38 |
| ▸ | FGFR1 | P11362 | 2/20 | 0.37 |
| ▸ | FGFR2 | P21802 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL10140130 | 0.78 | HDAC3 (0.43) | CHEK1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL16258968 | 0.76 | HDAC3 (0.42) | CHEK1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL7974939 | 0.73 | HDAC6 (0.59) | CHEK1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL7960749 | 0.71 | HDAC3 (0.43) | CHEK1HDAC3HDAC1HDAC2HDAC8 | |
| SCHEMBL7973134 | 0.70 | F10 (0.64) | HDAC3HDAC1HDAC8HDAC6F9 | |
| SCHEMBL10139999 | 0.70 | HDAC6 (0.54) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL7969308 | 0.70 | TSPO (0.37) | KDRSYK | |
| SCHEMBL18229740 | 0.69 | HDAC6 (0.84) | HDAC3HDAC1HDAC2HDAC8HDAC6 | |
| SCHEMBL7960699 | 0.68 | F10 (0.67) | F9F10F11F7MAPKAPK5 | |
| SCHEMBL20307774 | 0.68 | F10 (0.67) | F9F10F11F7 |
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-2009143039-A2 | HETEROCYCLIC COMPOUNDS AS FACTOR IXA INHIBITORS | SCHERING CORPORATION (US) | 2009-11-26 | — | — | WO | disclosed |