Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCNB2 | O95067 | 1/20 | 0.51 |
| ▸ | CDK1 | P06493 | 1/20 | 0.51 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.51 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.51 |
| ▸ | CDK2 | P24941 | 1/20 | 0.51 |
| ▸ | CCNA1 | P78396 | 1/20 | 0.51 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.51 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.51 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.51 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | TDO2 | P48775 | 1/20 | 0.41 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.41 |
| ▸ | TYMS | P04818 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | TRPA1 | O75762 | 4/20 | 0.38 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | APEX1 | P27695 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17861316 | 0.87 | CYP2A6 (0.53) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL2757276 | 0.79 | CYP2A6 (0.53) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL21870525 | 0.79 | MAPT (0.61) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL26696146 | 0.79 | CDK2 (0.37) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL12405289 | 0.78 | CYP1A2 (0.48) | CYP2A6TYMSLMNAMAPTKIF11 | |
| SCHEMBL21864506 | 0.78 | CCNB2 (0.38) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL26873305 | 0.76 | CYP2A6 (0.70) | CYP2A6TDO2CYP3A4LMNAMAPT | |
| SCHEMBL14341059 | 0.76 | CYP2A6 (0.70) | CYP2A6TDO2CYP3A4LMNAMAPT | |
| SCHEMBL26873052 | 0.75 | CYP2A6 (0.53) | CCNB2CDK1CCNB1CCNA2CDK2 | |
| SCHEMBL12266516 | 0.73 | CYP2A6 (0.56) | CCNB2CDK1CCNB1CCNA2CDK2 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3842444-A1 | ORGANOMETALLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME AND ELECTRONIC APPARATUS INCLUDING THE ORGANIC LIGHT-EMITTING DEVICE | Samsung Electronics Co., Ltd. (KR) | 2021-06-30 | — | — | EP | disclosed |