Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | PAX3 | P23760 | 1/20 | 0.36 |
| ▸ | FOXO1 | Q12778 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.35 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.34 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | MDM4 | O15151 | 1/20 | 0.32 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | RAF1 | P04049 | 1/20 | 0.32 |
| ▸ | BRAF | P15056 | 1/20 | 0.32 |
| ▸ | TYMS | P04818 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | XIAP | P98170 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL22639183 | 0.73 | TSHR (0.42) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL442818 | 0.72 | NOS1 (0.45) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL20869901 | 0.71 | TYMS (0.41) | TYMS | |
| SCHEMBL22036469 | 0.69 | ALDH1A1 (0.43) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL735411 | 0.69 | GDA (0.72) | GDA | |
| SCHEMBL15061831 | 0.68 | TYMS (0.48) | KDM4ECHEK1ALDH1A1TYMSLMNA | |
| SCHEMBL18490337 | 0.68 | NOS1 (0.41) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL8886595 | 0.66 | NOS1 (0.38) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL4337068 | 0.66 | PAX3 (0.39) | NOS1KDM4EPAX3FOXO1TSHR | |
| SCHEMBL3797825 | 0.65 | SMN1; SMN2 (0.47) | KDM4EGDAADORA3ADORA2ATP53 |
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-2018071531-A1 | HPPK INHIBITORS USEFUL AS ANTIBACTERIAL AGENTS | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2018-04-19 | — | — | WO | disclosed |