Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 1/20 | 0.63 |
| ▸ | CSF1R | P07333 | 1/20 | 0.63 |
| ▸ | CDK1 | P06493 | 5/20 | 0.49 |
| ▸ | CDK2 | P24941 | 5/20 | 0.49 |
| ▸ | CCNB1 | P14635 | 4/20 | 0.49 |
| ▸ | CCNA2 | P20248 | 4/20 | 0.49 |
| ▸ | CCNA1 | P78396 | 4/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.49 |
| ▸ | MGMT | P16455 | 3/20 | 0.49 |
| ▸ | PIN1 | Q13526 | 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 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL28004524 | 0.86 | EGFR (0.47) | EGFRCSF1RCDK1CDK2CCNB1 | |
| SCHEMBL28004539 | 0.84 | BRAF (0.54) | EGFRCSF1RCDK2MGMTPIN1 | |
| SCHEMBL28004526 | 0.84 | CDK2 (0.47) | EGFRCSF1RCDK1CDK2CCNB1 | |
| SCHEMBL28004918 | 0.81 | PDPK1 (0.44) | EGFRCSF1RCDK1CDK2CCNB1 | |
| SCHEMBL401117 | 0.80 | PDPK1 (0.59) | CDK1CDK2CCNB1CCNA2CCNA1 | |
| SCHEMBL28252150 | 0.78 | EGFR (0.54) | EGFRCSF1RCDK1CDK2CCNB1 | |
| SCHEMBL28251683 | 0.77 | BRAF (0.59) | CDK1CDK2CCNB1CCNA2CCNA1 | |
| SCHEMBL30523367 | 0.76 | ALDH1A1 (0.48) | EGFRCSF1RCDK1CDK2CCNB1 | |
| SCHEMBL887836 | 0.75 | DPP4 (0.44) | CDK1CDK2CCNB1CCNA2CCNA1 | |
| SCHEMBL28817715 | 0.72 | BRAF (0.50) | CDK1CDK2CCNB1CCNA2CCNA1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6197775-B1 | VIRICIDES | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-03-06 | — | — | US | disclosed |
| EP-0832896-A1 | PHOSPHONATE NUCLEOTIDE DERIVATIVES | MITSUBISHI CHEMICAL CORPORATION (JP) | 1998-04-01 | — | — | EP | disclosed |