Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIN1 | Q13526 | 7/20 | 0.43 |
| ▸ | RXRA | P19793 | 3/20 | 0.43 |
| ▸ | RXRB | P28702 | 3/20 | 0.43 |
| ▸ | RXRG | P48443 | 2/20 | 0.43 |
| ▸ | MGMT | P16455 | 5/20 | 0.43 |
| ▸ | CDK1 | P06493 | 2/20 | 0.43 |
| ▸ | CCNB1 | P14635 | 2/20 | 0.43 |
| ▸ | CCNA2 | P20248 | 2/20 | 0.43 |
| ▸ | CDK2 | P24941 | 2/20 | 0.43 |
| ▸ | CCNA1 | P78396 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 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 | |
|---|---|---|---|---|
| SCHEMBL8903375 | 0.85 | RXRA (0.43) | RXRARXRBRXRGNR4A2GAA | |
| SCHEMBL8903387 | 0.81 | CDK1 (0.39) | PIN1MGMTCDK1CCNB1CCNA2 | |
| SCHEMBL8902502 | 0.80 | CDK1 (0.55) | PIN1MGMTCDK1CCNB1CCNA2 | |
| SCHEMBL8901822 | 0.79 | PTGS2 (0.46) | — | |
| SCHEMBL8903318 | 0.79 | CDK1 (0.53) | PIN1MGMTCDK1CCNB1CCNA2 | |
| SCHEMBL8901655 | 0.77 | CDK1 (0.55) | PIN1MGMTCDK1CCNB1CCNA2 | |
| SCHEMBL8902911 | 0.77 | CDK1 (0.55) | PIN1MGMTCDK1CCNB1CCNA2 | |
| SCHEMBL8902849 | 0.76 | CA1 (0.43) | — | |
| SCHEMBL8903481 | 0.73 | DAPK1 (0.45) | RXRARXRBRXRGGAAMAPT | |
| SCHEMBL9854008 | 0.73 | RXRA (0.63) | RXRARXRBRXRGTSHRNR4A2 |
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-5602140-A | CAUSED BY LEUKOCYTES | JAPAN ENERGY CORPORATION (JP) | 1997-02-11 | — | — | US | disclosed |
| EP-0675124-A2 | Purine derivatives and suppressants for inflammatory diseases | JAPAN ENERGY CORPORATION (JP) | 1995-10-04 | — | — | EP | disclosed |