Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | GLA | P06280 | 1/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 1/20 | 0.56 |
| ▸ | CDK4 | P11802 | 3/20 | 0.53 |
| ▸ | CCND1 | P24385 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.44 |
| ▸ | KIF11 | P52732 | 2/20 | 0.44 |
| ▸ | ACHE | P22303 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | METAP2 | P50579 | 1/20 | 0.42 |
| ▸ | CHUK | O15111 | 1/20 | 0.42 |
| ▸ | ITK | Q08881 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.41 |
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | HTR2C | P28335 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL12219467 | 0.83 | CDK4 (0.56) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL23966739 | 0.82 | CDK4 (0.65) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL12219477 | 0.82 | CDK4 (0.54) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL12219480 | 0.82 | CDK4 (0.54) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL29385261 | 0.81 | CDK4 (0.68) | KDM4EALDH1A1GLAGAAHTT | |
| SCHEMBL257083 | 0.81 | CDK4 (0.68) | KDM4EALDH1A1GLAGAAHTT | |
| SCHEMBL17228823 | 0.81 | AHR (0.64) | KDM4EALDH1A1CDK4CCND1KIF11 | |
| SCHEMBL29405999 | 0.80 | CDK4 (0.53) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL16048023 | 0.80 | CDK4 (0.53) | KDM4EALDH1A1CDK4CCND1CYP2A6 | |
| SCHEMBL12219456 | 0.80 | CDK4 (0.53) | KDM4EALDH1A1CDK4CCND1CYP2A6 |
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-2010114264-A2 | NOVEL ORGANIC ELECTROLUMINESCENT COMPOUNDS AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | DOW ADVANCED DISPLAY MATERIALS,LTD. (KR) | 2010-10-07 | — | — | WO | disclosed |