Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 6/20 | 0.39 |
| ▸ | NPC1 | O15118 | 4/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KIF11 | P52732 | 1/20 | 0.39 |
| ▸ | GRIN2D | O15399 | 1/20 | 0.38 |
| ▸ | GRIN3B | O60391 | 1/20 | 0.38 |
| ▸ | GRIN1 | Q05586 | 1/20 | 0.38 |
| ▸ | GRIN2A | Q12879 | 1/20 | 0.38 |
| ▸ | GRIN2B | Q13224 | 1/20 | 0.38 |
| ▸ | GRIN2C | Q14957 | 1/20 | 0.38 |
| ▸ | GRIN3A | Q8TCU5 | 1/20 | 0.38 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL28827980 | 0.77 | LMNA (0.38) | SMN1; SMN2RAB9ANPC1ALDH1A1LMNA | |
| SCHEMBL2086180 | 0.76 | ALDH1A1 (0.44) | SMN1; SMN2HPGDNFKB1RAB9AALDH1A1 | |
| SCHEMBL6158941 | 0.76 | ALDH1A1 (0.44) | SMN1; SMN2HPGDNFKB1RAB9ANPC1 | |
| SCHEMBL4739958 | 0.76 | RAB9A (0.42) | SMN1; SMN2HPGDNFKB1RAB9ANPC1 | |
| SCHEMBL2631300 | 0.73 | ALDH1A1 (0.37) | SMN1; SMN2ALDH1A1POLBKDM4ELMNA | |
| SCHEMBL449614 | 0.72 | TSHR (0.43) | HPGDALDH1A1LMNAMAPTMEN1 | |
| SCHEMBL29950147 | 0.71 | NFKB1 (0.59) | SMN1; SMN2HPGDNFKB1RAB9ANPC1 | |
| SCHEMBL28833363 | 0.71 | ALDH1A1 (0.48) | SMN1; SMN2HPGDNFKB1RAB9ANPC1 | |
| SCHEMBL3958499 | 0.71 | NFKB1 (0.59) | SMN1; SMN2HPGDNFKB1RAB9ANPC1 | |
| SCHEMBL2064181 | 0.70 | MAPT (0.54) | SMN1; SMN2HPGDNFKB1ALDH1A1KDM4E |
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 |
|---|---|---|---|---|---|---|---|
| CN-114105806-A | Novel acetylenic acid ester and acetylenic amide plant antibacterial agent | 西北农林科技大学 | 2022-03-01 | — | — | CN | disclosed |