Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGMT | P16455 | 4/20 | 0.55 |
| ▸ | CDK1 | P06493 | 2/20 | 0.55 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.55 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.55 |
| ▸ | CDK2 | P24941 | 2/20 | 0.55 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | MPO | P05164 | 1/20 | 0.52 |
| ▸ | TPO | P07202 | 1/20 | 0.52 |
| ▸ | EPX | P11678 | 1/20 | 0.52 |
| ▸ | LMNA | P02545 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | BLM | P54132 | 1/20 | 0.52 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.52 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL18049874 | 0.83 | NUDT1 (0.55) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL669089 | 0.83 | MGMT (0.52) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL16852229 | 0.80 | MGMT (0.64) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL3305092 | 0.77 | PIN1 (0.71) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL3338311 | 0.76 | MGMT (0.68) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL17597659 | 0.76 | L3MBTL1 (0.44) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL20595507 | 0.76 | MGMT (0.48) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL30026947 | 0.76 | MGMT (0.48) | MGMTCDK1CCNB1CCNA2CDK2 | |
| SCHEMBL19274230 | 0.76 | DCPS (0.57) | DHFR | |
| Hydrochloric Acid SCHEMBL25369331 | 0.75 | MGMT (0.47) | MGMTCDK1CCNB1CCNA2CDK2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1066266-A1 | CYCLIN DEPENDENT KINASE INHIBITORS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 2001-01-10 | — | — | EP | disclosed |
| WO-1999050251-A2 | CYCLIN DEPENDENT KINASE INHIBITORS | CANCER RESEARCH CAMPAIGN TECHNOLOGY LIMITED (GB) | 1999-10-07 | — | — | WO | disclosed |