Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MET | P08581 | 1/20 | 0.37 |
| ▸ | AURKA | O14965 | 4/20 | 0.37 |
| ▸ | ESR1 | P03372 | 6/20 | 0.37 |
| ▸ | ESR2 | Q92731 | 6/20 | 0.37 |
| ▸ | KDR | P35968 | 3/20 | 0.36 |
| ▸ | NOS1 | P29475 | 4/20 | 0.36 |
| ▸ | AXL | P30530 | 1/20 | 0.36 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.35 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.35 |
| ▸ | PRKCG | P05129 | 1/20 | 0.35 |
| ▸ | PRKCB | P05771 | 1/20 | 0.35 |
| ▸ | GLI1 | P08151 | 1/20 | 0.35 |
| ▸ | GLI2 | P10070 | 1/20 | 0.35 |
| ▸ | CDK4 | P11802 | 1/20 | 0.35 |
| ▸ | PRKCA | P17252 | 1/20 | 0.35 |
| ▸ | CTRB1 | P17538 | 1/20 | 0.35 |
| ▸ | PRKACA | P17612 | 1/20 | 0.35 |
| ▸ | PRKACG | P22612 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL30856318 | 0.73 | MAPT (0.38) | METAURKAKDRNOS1PRKCI | |
| SCHEMBL13950666 | 0.72 | PARP1 (0.50) | AURKAKDRPRKD3PRKCGPRKCB | |
| SCHEMBL30930574 | 0.70 | CDC7 (0.49) | AURKAKDRCDK2PRKD3PRKCG | |
| SCHEMBL5893986 | 0.69 | CES1 (0.44) | ESR1ESR2NOS1AXLCCNA2 | |
| SCHEMBL12321248 | 0.69 | NOS1 (0.56) | NOS1AXLCCNA2CDK2CCNA1 | |
| SCHEMBL30924211 | 0.67 | MAPK10 (0.40) | METAURKAKDRCDK2PRKD3 | |
| SCHEMBL31069613 | 0.67 | AURKA (0.47) | AURKAKDRPRKD3PRKCGPRKCB | |
| SCHEMBL25757649 | 0.67 | MAPT (0.48) | AURKAKDRCDK1CA12CA9 | |
| SCHEMBL30775188 | 0.66 | METAP2 (0.50) | METAURKANOS1AXLROCK2 | |
| SCHEMBL2198319 | 0.65 | — | — |
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-2023098880-A1 | FUSED RING DERIVATIVE, PREPARATION METHOD THEREFOR, AND APPLICATION THEREOF | 上海翰森生物医药科技有限公司 | 2023-06-08 | — | — | WO | disclosed |