Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.48 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | SMPD1 | P17405 | 1/20 | 0.43 |
| ▸ | SAE1 | Q9UBE0 | 1/20 | 0.42 |
| ▸ | UBA2 | Q9UBT2 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | MAOB | P27338 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.42 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA3 | P07451 | 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 | |
|---|---|---|---|---|
| SCHEMBL30542088 | 0.87 | KMT2A (0.45) | TSHRTDP1L3MBTL1ALDH1A1 | |
| SCHEMBL11844391 | 0.80 | GAA (0.51) | GAATSHRTDP1RAB9AL3MBTL1 | |
| SCHEMBL28850294 | 0.79 | CYP3A4 (0.44) | ALDH1A1 | |
| SCHEMBL3292009 | 0.79 | ALDH1A1 (0.58) | GAATSHRTDP1RAB9ASMPD1 | |
| SCHEMBL27930570 | 0.79 | MMP1 (0.45) | RAB9AL3MBTL1MAOBMAPT | |
| Hydrochloric Acid SCHEMBL11844386 | 0.79 | GAA (0.50) | GAATSHRTDP1RAB9AL3MBTL1 | |
| SCHEMBL28850335 | 0.79 | RXRA (0.44) | GAATSHRTDP1RAB9AL3MBTL1 | |
| SCHEMBL114536 | 0.79 | GAA (0.54) | GAATSHRTDP1RAB9ASMPD1 | |
| SCHEMBL2659564 | 0.79 | ALDH1A1 (0.58) | GAATSHRTDP1RAB9AL3MBTL1 | |
| SCHEMBL28123967 | 0.79 | KMT2A (0.50) | TDP1L3MBTL1HTTMAOBALDH1A1 |
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 |