Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PNP | P00491 | 1/20 | 0.44 |
| ▸ | ADORA3 | P0DMS8 | 3/20 | 0.44 |
| ▸ | ADORA2B | P29275 | 3/20 | 0.44 |
| ▸ | CDK1 | P06493 | 3/20 | 0.43 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MGMT | P16455 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.43 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6952184 | 0.81 | SLC2A1 (0.41) | PNPADORA3ADORA2BCDK1CCNB1 | |
| SCHEMBL17186305 | 0.81 | PNP (0.39) | PNPADORA3ADORA2BPOLBKMT2A | |
| SCHEMBL6266585 | 0.80 | CDK1 (0.40) | PNPADORA2BCDK1PIN1CCNB1 | |
| SCHEMBL6751932 | 0.79 | PNP (0.43) | PNPADORA2BCDK1CYP1A2CCNB1 | |
| SCHEMBL2385930 | 0.79 | ADORA2B (0.50) | PNPADORA2BCDK1CYP1A2CCNB1 | |
| SCHEMBL28061198 | 0.79 | PNP (0.39) | PNPADORA3ADORA2BCDK1PIN1 | |
| SCHEMBL9806974 | 0.78 | PNP (0.44) | PNPADORA2BCDK1CYP1A2CCNB1 | |
| SCHEMBL22090217 | 0.78 | PNP (0.42) | PNPADORA3ADORA2BCDK1PIN1 | |
| SCHEMBL985176 | 0.77 | PNP (0.43) | PNPADORA3ADORA2BCDK1PIN1 | |
| SCHEMBL441798 | 0.77 | DPP4 (0.44) | PNPADORA2BCDK1CYP1A2CCNB1 |
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-1720332-A | O6Substrates for -alkylguanine-DNA alkyltransferases | ECOLE POLYTECH (CH) | 2006-01-11 | — | — | CN | disclosed |