Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 5/20 | 0.53 |
| ▸ | CDK1 | P06493 | 4/20 | 0.53 |
| ▸ | CDK2 | P24941 | 4/20 | 0.53 |
| ▸ | CCNB1 | P14635 | 3/20 | 0.53 |
| ▸ | CCNA2 | P20248 | 3/20 | 0.53 |
| ▸ | CCNA1 | P78396 | 3/20 | 0.53 |
| ▸ | DPP4 | P27487 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | PIN1 | Q13526 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.49 |
| ▸ | BLM | P54132 | 1/20 | 0.49 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.49 |
| ▸ | ENPP1 | P22413 | 1/20 | 0.46 |
| ▸ | NUDT1 | P36639 | 2/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4845432 | 0.96 | CDK2 (0.53) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL2930276 | 0.76 | CDK1 (0.62) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL4845428 | 0.74 | POLB (0.47) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL134909 | 0.74 | PDPK1 (0.49) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL28055654 | 0.72 | DPP4 (0.54) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL27806644 | 0.72 | DPP4 (0.54) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL24846433 | 0.71 | CYP1A2 (0.79) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL27438882 | 0.71 | CDK2 (0.53) | MGMTCDK1CDK2CCNB1CCNA2 | |
| SCHEMBL5804085 | 0.70 | HSD17B10 (0.59) | POLBALDH1A1HPGDHSD17B10 | |
| SCHEMBL9872864 | 0.69 | CYP1A2 (0.67) | MGMTCDK1CDK2CCNB1CCNA2 |
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-101172992-A | Modified 2' and 3'-nucleoside prodrugs for treating flaviviridae infections | CENTRE NAT RECH SCIENT (KY) | 2008-05-07 | — | — | CN | disclosed |
| CN-1761677-A | Modified 2 'and 3' -nucleoside prodrugs for treating flavivirus infections | IDENIX CAYMAN LTD (KY) | 2006-04-19 | — | — | CN | disclosed |