Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KLKB1 | P03952 | 1/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.39 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.38 |
| ▸ | AR | P10275 | 2/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
| ▸ | RET | P07949 | 1/20 | 0.37 |
| ▸ | CCR9 | P51686 | 1/20 | 0.36 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.36 |
| ▸ | PDE9A | O76083 | 2/20 | 0.36 |
| ▸ | CYP11B1 | P15538 | 1/20 | 0.35 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.35 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.35 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | DAO | P14920 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL21492003 | 1.00 | KLKB1 (0.41) | KLKB1KCNH2GRIN1GRIN2BCYP19A1 | |
| SCHEMBL17685589 | 0.82 | KLKB1 (0.42) | KLKB1CYP19A1ARPGRCYP11B1 | |
| SCHEMBL25269987 | 0.79 | GRIN1 (0.40) | KCNH2GRIN1GRIN2BRETTRPV4 | |
| SCHEMBL21503682 | 0.78 | LOXL2 (0.40) | KLKB1KCNH2GRIN1GRIN2BTRPV4 | |
| SCHEMBL21491519 | 0.77 | GLS (0.38) | KLKB1KCNH2GRIN1GRIN2BPGR | |
| Hydrochloric Acid SCHEMBL21491894 | 0.77 | LMNA (0.41) | KLKB1KCNH2GRIN1GRIN2BTRPV4 | |
| SCHEMBL26202009 | 0.77 | CYP3A4 (0.40) | GRIN1GRIN2BTRPV4LMNAMAPT | |
| Hydrochloric Acid SCHEMBL30744436 | 0.77 | LMNA (0.41) | KLKB1KCNH2GRIN1GRIN2BTRPV4 | |
| SCHEMBL24401098 | 0.76 | GRIN1 (0.38) | GRIN1GRIN2BTRPV4PDE9ACYP11B1 | |
| SCHEMBL21492571 | 0.76 | GRIN1 (0.38) | KCNH2GRIN1GRIN2BTRPV4LMNA |
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 |