Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.46 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.46 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.46 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.46 |
| ▸ | GRIK5 | Q16478 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.42 |
| ▸ | DRD3 | P35462 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TK2 | O00142 | 4/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL6760088 | 0.84 | CYP1A2 (0.62) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL10976239 | 0.82 | CYP1A2 (0.60) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL591921 | 0.82 | LMNA (0.51) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL3465151 | 0.81 | TK2 (0.56) | KMT2ACYP2C9MAPTCYP1A2CYP2C19 | |
| SCHEMBL17232952 | 0.80 | LMNA (0.47) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL11093962 | 0.80 | LMNA (0.60) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL3568484 | 0.80 | LMNA (0.52) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL19103048 | 0.78 | LMNA (0.58) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL13460715 | 0.78 | LMNA (0.48) | LMNAKMT2ACYP2C9MAPTCYP1A2 | |
| SCHEMBL22847567 | 0.78 | LMNA (0.60) | LMNAKMT2ACYP2C9MAPTCYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112062790-B | 5-Fu-ruthenium (II) complex with anti-tumor and antibacterial activities and preparation method and application thereof | 广东医科大学 | 2022-09-23 | — | — | CN | disclosed |
| CN-112062790-A | 5-Fu-ruthenium (II) complex with anti-tumor and antibacterial activities and preparation method and application thereof | 广东医科大学 | 2020-12-11 | — | — | CN | disclosed |