Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PARP1 | P09874 | 7/20 | 0.57 |
| ▸ | CDK4 | P11802 | 3/20 | 0.45 |
| ▸ | CCND1 | P24385 | 3/20 | 0.45 |
| ▸ | CDK5 | Q00535 | 2/20 | 0.42 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.42 |
| ▸ | GSK3A | P49840 | 1/20 | 0.42 |
| ▸ | GSK3B | P49841 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | CHEK1 | O14757 | 4/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.39 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.39 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.39 |
| ▸ | PRKCG | P05129 | 1/20 | 0.39 |
| ▸ | PRKCB | P05771 | 1/20 | 0.39 |
| ▸ | CDK1 | P06493 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL549156 | 0.76 | CDK4 (0.57) | PARP1CDK4CCND1CDK5CDK5R1 | |
| SCHEMBL8662857 | 0.71 | PARP1 (0.50) | PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL8661416 | 0.71 | PARP1 (0.50) | PARP1SMN1; SMN2KDM4EALDH1A1HSD17B10 | |
| SCHEMBL14980870 | 0.70 | PARP1 (1.00) | PARP1CDK4CCND1CDK5CDK5R1 | |
| SCHEMBL11903054 | 0.69 | CDK4 (0.55) | PARP1CDK4CCND1CDK5CDK5R1 | |
| SCHEMBL2086780 | 0.69 | PARP1 (1.00) | PARP1 | |
| SCHEMBL3295713 | 0.67 | TDP2 (0.44) | PARP1CDK4CCND1CDK5CDK5R1 | |
| SCHEMBL3898671 | 0.66 | PARP1 (0.45) | PARP1KDM4EALDH1A1MEN1KMT2A | |
| SCHEMBL28692164 | 0.66 | KDM4E (0.44) | SMN1; SMN2KDM4EALDH1A1MAPTHSD17B10 | |
| SCHEMBL3672266 | 0.66 | CDK4 (0.47) | PARP1CDK4CCND1CDK5CDK5R1 |
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-9692049-B2 | Anode containing composite anode active material including water-soluble polymer coating and lithium secondary battery including the same | SAMSUNG ELECTRONICS CO., LTD. (KR) | 2017-06-27 | — | — | US | disclosed |
| US-20140242461-A1 | ANODE FOR LITHIUM SECONDARY BATTERY AND LITHIUM SECONDARY BATTERY INCLUDING THE SAME | SAMSUNG SDI CO., LTD. (KR) | 2014-08-28 | — | — | US | disclosed |