Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | GRN | P28799 | 1/20 | 0.35 |
| ▸ | SORT1 | Q99523 | 1/20 | 0.35 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.34 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.32 |
| ▸ | AURKA | O14965 | 1/20 | 0.32 |
| ▸ | CSF1R | P07333 | 1/20 | 0.32 |
| ▸ | RET | P07949 | 1/20 | 0.32 |
| ▸ | LTK | P29376 | 1/20 | 0.32 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.32 |
| ▸ | CDK8 | P49336 | 1/20 | 0.32 |
| ▸ | CLK2 | P49760 | 1/20 | 0.32 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.32 |
| ▸ | ACVR1 | Q04771 | 1/20 | 0.32 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.32 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.31 |
| ▸ | TTK | P33981 | 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 | |
|---|---|---|---|---|
| SCHEMBL16629284 | 0.87 | GRN (0.49) | BRD4KDM4EGRNSORT1PAX8 | |
| SCHEMBL29664520 | 0.80 | BRD4 (0.36) | BRD4KDM4EGRNSORT1AAK1 | |
| SCHEMBL16629289 | 0.78 | BRD4 (0.31) | BRD4 | |
| SCHEMBL16384545 | 0.77 | HTR2C (0.47) | KDM4EGRNSORT1AAK1AURKA | |
| SCHEMBL16629274 | 0.77 | BRD4 (0.34) | BRD4KDM4EPAX8HTR2CSLC6A4 | |
| SCHEMBL15273681 | 0.76 | AAK1 (0.34) | KDM4EGRNSORT1AAK1 | |
| SCHEMBL18019577 | 0.74 | BRD4 (0.35) | BRD4AAK1PAX8TTK | |
| SCHEMBL22445393 | 0.71 | CNR2 (0.32) | BRD4HTR2CSLC6A4 | |
| SCHEMBL16629271 | 0.71 | BRD4 (0.38) | BRD4KDM4EPAX8HTR2CSLC6A4 | |
| SCHEMBL16629231 | 0.70 | IRAK4 (0.40) | KDM4EGRNSORT1 |
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-2015050989-A2 | MACROCYCLIC COMPOUNDS FOR THE TREATMENT OF PROLIFERATIVE DISEASES | CS THERAPEUTICS INC. (US) | 2015-04-09 | — | — | WO | disclosed |