Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.43 |
| ▸ | PDE10A | Q9Y233 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.31 |
| ▸ | HPGD | P15428 | 2/20 | 0.31 |
| ▸ | CDK7 | P50613 | 2/20 | 0.31 |
| ▸ | CDK9 | P50750 | 2/20 | 0.31 |
| ▸ | CDK13 | Q14004 | 1/20 | 0.31 |
| ▸ | CDK12 | Q9NYV4 | 1/20 | 0.31 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.31 |
| ▸ | SRC | P12931 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.30 |
| ▸ | CCNH | P51946 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL21222 | 0.82 | CRHR1 (0.31) | — | |
| SCHEMBL19818 | 0.82 | PDE10A (0.41) | CDK2PDE10ACDK7CDK9CDK13 | |
| SCHEMBL15032989 | 0.77 | CHEK1 (0.44) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL21498 | 0.74 | CDK2 (0.53) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL30813 | 0.73 | CRHR1 (0.31) | — | |
| SCHEMBL7886484 | 0.73 | CDK2 (0.47) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL10236643 | 0.73 | CDK2 (0.51) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL585004 | 0.73 | CDK2 (0.51) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL7846641 | 0.72 | CHEK1 (0.68) | CDK2CHEK1CCNA2CCNA1PDE10A | |
| SCHEMBL20634 | 0.72 | KDM4E (0.32) | KDM4EHSD17B10 |
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-2012027234-A1 | FUSED TRICYCLIC INHIBITORS OF MAMMALIAN TARGET OF RAPAMYCIN | SCHERING CORPORATION (US) | 2012-03-01 | — | — | WO | disclosed |