Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDPK1 | O15530 | 1/20 | 0.61 |
| ▸ | GDA | Q9Y2T3 | 1/20 | 0.61 |
| ▸ | CDK2 | P24941 | 13/20 | 0.58 |
| ▸ | DPP4 | P27487 | 1/20 | 0.58 |
| ▸ | MAP3K5 | Q99683 | 1/20 | 0.53 |
| ▸ | CDK1 | P06493 | 13/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 13/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 12/20 | 0.51 |
| ▸ | CCNA1 | P78396 | 12/20 | 0.51 |
| ▸ | MGMT | P16455 | 7/20 | 0.50 |
| ▸ | PIN1 | Q13526 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.48 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | BLM | P54132 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL29720347 | 0.84 | MAP3K5 (0.60) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL31642104 | 0.84 | PDPK1 (0.59) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL7668710 | 0.81 | PDPK1 (0.56) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL9706197 | 0.80 | PDPK1 (0.42) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL9683225 | 0.78 | CDK2 (0.55) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL72543 | 0.77 | CDK2 (0.62) | PDPK1GDACDK2DPP4CDK1 | |
| SCHEMBL4455870 | 0.77 | CDK2 (0.62) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL355362 | 0.77 | PDPK1 (0.66) | PDPK1GDACDK2DPP4MAP3K5 | |
| 2,6-Diaminopurine SCHEMBL24053 | 0.76 | PDPK1 (1.00) | PDPK1GDACDK2DPP4MAP3K5 | |
| SCHEMBL2027219 | 0.76 | CDK2 (0.50) | PDPK1GDACDK2DPP4MAP3K5 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102659785-B | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2014-04-30 | — | — | CN | disclosed |
| CN-102659785-B | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2014-04-30 | — | — | CN | disclosed |
| CN-102659785-B | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2014-04-30 | — | — | CN | disclosed |
| CN-102659785-A | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2012-09-12 | — | — | CN | disclosed |
| CN-102659785-A | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2012-09-12 | — | — | CN | disclosed |
| CN-102659785-A | 2-amino-6-aminomethylpurine compound and preparation method and application thereof | UNIV SHANDONG | 2012-09-12 | — | — | CN | disclosed |