Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDK2 | Q15119 | 2/20 | 0.41 |
| ▸ | TYMS | P04818 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 2/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.36 |
| ▸ | ATM | Q13315 | 2/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | MEN1 | O00255 | 3/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | MAOA | P21397 | 1/20 | 0.36 |
| ▸ | DHFR | P00374 | 4/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL24744980 | 0.83 | DHFR (0.40) | PDK2TYMSALDH1A1TSHRHSD17B10 | |
| SCHEMBL9936344 | 0.80 | PDK2 (0.56) | PDK2ALDH1A1TSHRMAPK1HSD17B10 | |
| SCHEMBL29518254 | 0.78 | ALDH1A1 (0.50) | TYMSALDH1A1TSHRMAPK1ATM | |
| SCHEMBL17263918 | 0.78 | ALDH1A1 (0.50) | TYMSALDH1A1TSHRMAPK1ATM | |
| SCHEMBL592159 | 0.76 | ALDH1A1 (0.42) | TYMSALDH1A1TSHRMAPK1ATM | |
| SCHEMBL31395712 | 0.75 | ALDH1A1 (0.50) | TYMSALDH1A1TSHRMAPK1ATM | |
| SCHEMBL24744577 | 0.75 | TYMS (0.37) | PDK2TYMSALDH1A1TSHRMAPK1 | |
| SCHEMBL11811052 | 0.75 | PDK2 (0.42) | PDK2ALDH1A1MAPK1ATMHSD17B10 | |
| SCHEMBL5894727 | 0.74 | HSD17B10 (0.56) | PDK2ALDH1A1TSHRMAPK1ATM | |
| SCHEMBL13372146 | 0.74 | PDK2 (0.45) | PDK2ALDH1A1TSHRMAPK1ATM |
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-2022260240-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | 엘티소재주식회사 | 2022-12-15 | — | — | WO | disclosed |