Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 4/20 | 0.41 |
| ▸ | CDK2 | P24941 | 4/20 | 0.41 |
| ▸ | CDK1 | P06493 | 3/20 | 0.41 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.41 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.41 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.41 |
| ▸ | GDA | Q9Y2T3 | 2/20 | 0.40 |
| ▸ | PNP | P00491 | 1/20 | 0.40 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.35 |
| ▸ | PDE4A | P27815 | 2/20 | 0.34 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.34 |
| ▸ | PDE4C | Q08493 | 2/20 | 0.34 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.34 |
| ▸ | HRH4 | Q9H3N8 | 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 | |
|---|---|---|---|---|
| SCHEMBL218669 | 0.86 | MGMT (0.45) | MGMTCDK2CDK1CCNB1CCNA2 | |
| Bromide SCHEMBL8165615 | 0.85 | MGMT (0.44) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL6821773 | 0.81 | PNP (0.45) | MGMTCDK2GDAPNPDPP4 | |
| SCHEMBL453204 | 0.80 | CYP1A2 (0.41) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL28627686 | 0.80 | PNP (0.41) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL8843878 | 0.77 | PDE4A (0.43) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL3072987 | 0.76 | MGMT (0.45) | MGMTCDK2CDK1CCNB1CCNA2 | |
| Acetic Acid SCHEMBL5323943 | 0.76 | MGMT (0.44) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL6265538 | 0.76 | MGMT (0.47) | MGMTCDK2CDK1CCNB1CCNA2 | |
| SCHEMBL5694191 | 0.75 | NPC1 (0.51) | MGMTCDK2CDK1CCNB1CCNA2 |
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-112574376-B | Antibacterial polyurethane resin and preparation method thereof | 万华化学集团股份有限公司 | 2022-09-16 | — | — | CN | disclosed |
| CN-112574376-A | Antibacterial polyurethane resin and preparation method thereof | 万华化学集团股份有限公司 | 2021-03-30 | — | — | CN | disclosed |