Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP11B1 | P15538 | 3/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 2/20 | 0.36 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.35 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
| ▸ | RET | P07949 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 4/20 | 0.35 |
| ▸ | P2RX2 | Q9UBL9 | 4/20 | 0.35 |
| ▸ | DAO | P14920 | 2/20 | 0.34 |
| ▸ | PPARD | Q03181 | 1/20 | 0.34 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.33 |
| ▸ | MAOA | P21397 | 1/20 | 0.33 |
| ▸ | MAOB | P27338 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL21492945 | 1.00 | CYP11B1 (0.36) | CYP11B1TRPV4PDE9AGRIN1GRIN2B | |
| SCHEMBL21491764 | 0.77 | TRPV4 (0.37) | CYP11B1TRPV4GRIN1GRIN2BKCNH2 | |
| SCHEMBL30744362 | 0.77 | TRPV4 (0.37) | CYP11B1TRPV4GRIN1GRIN2BKCNH2 | |
| SCHEMBL24208607 | 0.76 | CPB1 (0.39) | CYP11B1TRPV4GRIN1GRIN2BKCNH2 | |
| SCHEMBL28524266 | 0.76 | CYP2C19 (0.38) | TRPV4GRIN1GRIN2BKCNH2DAO | |
| SCHEMBL19402035 | 0.75 | FNTA (0.46) | CYP11B1CYP11B2 | |
| SCHEMBL21492003 | 0.73 | KLKB1 (0.41) | CYP11B1TRPV4PDE9AGRIN1GRIN2B | |
| SCHEMBL30744376 | 0.73 | KLKB1 (0.41) | CYP11B1TRPV4PDE9AGRIN1GRIN2B | |
| SCHEMBL21407299 | 0.71 | HDAC6 (0.52) | — | |
| SCHEMBL21492711 | 0.71 | PPARD (0.42) | KCNH2PPARDKDM1AMAOAMAOB |
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 |
|---|---|---|---|---|---|---|---|
| CN-112218865-B | Pteridinone compounds and uses thereof | 沃泰克斯药物股份有限公司 | 2024-03-12 | — | — | CN | disclosed |