Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DDB1 | Q16531 | 1/20 | 0.40 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.40 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.39 |
| ▸ | TPSD1 | Q9BZJ3 | 1/20 | 0.39 |
| ▸ | TPSG1 | Q9NRR2 | 1/20 | 0.39 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA9 | Q16790 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | CHKA | P35790 | 1/20 | 0.36 |
| ▸ | GAA | P10253 | 3/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.35 |
| ▸ | CHRNA3 | P32297 | 1/20 | 0.35 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.35 |
| ▸ | CHRNB3 | Q05901 | 1/20 | 0.35 |
| ▸ | CHRNA6 | Q15825 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL13812370 | 0.92 | GAA (0.43) | KMT2ACA2ALDH1A1CHKAGAA | |
| SCHEMBL28466485 | 0.90 | GAA (0.45) | KMT2ACA2ALDH1A1CHKAGAA | |
| SCHEMBL30366241 | 0.87 | GAA (0.53) | POLBKMT2AALDH1A1GAASMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL6780782 | 0.83 | DDB1 (0.43) | DDB1CRBNPOLBKMT2ATPSAB1 | |
| SCHEMBL9276912 | 0.81 | TSHR (0.54) | DDB1CRBNKMT2ACA2ALDH1A1 | |
| SCHEMBL3833137 | 0.80 | TSHR (0.44) | POLBKMT2AALDH1A1F10USP19 | |
| Hydrochloric Acid SCHEMBL9669377 | 0.80 | TSHR (0.53) | DDB1CRBNPOLBKMT2AALDH1A1 | |
| SCHEMBL18743866 | 0.79 | F10 (0.35) | F10USP19 | |
| SCHEMBL1483515 | 0.79 | TSHR (0.55) | F10USP19 | |
| Hydrochloric Acid SCHEMBL2976440 | 0.79 | TSHR (0.43) | POLBKMT2AALDH1A1F10USP19 |
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-2023121378-A1 | (S)-2-(2-METHYLAZETIDIN-1-YL)PYRIMIDINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | 주식회사 엘지화학 | 2023-06-29 | — | — | WO | disclosed |