Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.37 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.35 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | SIRT2 | Q8IXJ6 | 1/20 | 0.35 |
| ▸ | PARP1 | P09874 | 5/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | NNMT | P40261 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL28039596 | 0.87 | KDM1A (0.43) | KDM1ATSHRHSD17B3LCKMKNK1 | |
| SCHEMBL27640042 | 0.74 | ALDH1A1 (0.36) | KDM4EALDH1A1TRPA1SMN1; SMN2 | |
| SCHEMBL22900627 | 0.73 | MEN1 (0.38) | KDM4EALDH1A1HSD17B10OPRM1SMN1; SMN2 | |
| SCHEMBL27730909 | 0.73 | PBRM1 (0.37) | OPRK1 | |
| SCHEMBL28413209 | 0.72 | LCK (0.39) | KDM1ATSHRHSD17B3LCKMKNK1 | |
| SCHEMBL25171204 | 0.71 | ALDH1A1 (0.49) | KDM1ATSHRKDM4EALDH1A1HSD17B10 | |
| SCHEMBL29790728 | 0.71 | KMT2A (0.36) | TSHRLCKMKNK1MKNK2KDM4E | |
| SCHEMBL21168435 | 0.70 | HSD17B3 (0.55) | KDM1ATSHRHSD17B3LCKKDM4E | |
| SCHEMBL19691161 | 0.70 | CDC7 (0.41) | TSHRLCKMKNK1MKNK2SIRT2 | |
| SCHEMBL4433792 | 0.70 | TSHR (0.53) | TSHRLCKMKNK1MKNK2ALDH1A1 |
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-2021031071-A1 | AMIDE DERIVATIVE AND USE THEREOF IN MEDICINE | 广东东阳光药业有限公司 | 2021-02-25 | — | — | WO | disclosed |