Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 10/20 | 0.51 |
| ▸ | CCND1 | P24385 | 10/20 | 0.51 |
| ▸ | CCNB2 | O95067 | 1/20 | 0.40 |
| ▸ | CCNE2 | O96020 | 1/20 | 0.40 |
| ▸ | CDK1 | P06493 | 1/20 | 0.40 |
| ▸ | CCNB1 | P14635 | 1/20 | 0.40 |
| ▸ | CCNE1 | P24864 | 1/20 | 0.40 |
| ▸ | CDK2 | P24941 | 1/20 | 0.40 |
| ▸ | CCNB3 | Q8WWL7 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.37 |
| ▸ | RAB9A | P51151 | 2/20 | 0.37 |
| ▸ | PLK4 | O00444 | 1/20 | 0.37 |
| ▸ | MAPK9 | P45984 | 1/20 | 0.37 |
| ▸ | LIMK1 | P53667 | 1/20 | 0.37 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.37 |
| ▸ | AKT3 | Q9Y243 | 1/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL25505438 | 0.90 | CDK4 (0.44) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL25505436 | 0.90 | CDK4 (0.46) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL24839685 | 0.86 | CDK4 (0.43) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL21630342 | 0.84 | ALDH1A1 (0.54) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL23024713 | 0.78 | CDK4 (0.46) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL24245725 | 0.78 | ALDH1A1 (0.48) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL4590261 | 0.78 | ALDH1A1 (0.59) | RAB9AMAPK1ALDH1A1TSHRATM | |
| SCHEMBL23945224 | 0.77 | CDK4 (0.71) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL21650714 | 0.76 | CDK4 (0.47) | CDK4CCND1CCNB2CCNE2CDK1 | |
| SCHEMBL21765723 | 0.76 | CDK4 (0.60) | CDK4CCND1CCNB2CCNE2CDK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023277313-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2023-01-05 | — | — | WO | disclosed |