Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | COMT | P21964 | 1/20 | 0.39 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.34 |
| ▸ | HPGD | P15428 | 2/20 | 0.34 |
| ▸ | HSD17B3 | P37058 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | NOX1 | Q9Y5S8 | 1/20 | 0.33 |
| ▸ | IDO1 | P14902 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.32 |
| ▸ | SLC22A12 | Q96S37 | 1/20 | 0.32 |
| ▸ | BCHE | P06276 | 1/20 | 0.32 |
| ▸ | DHODH | Q02127 | 1/20 | 0.32 |
| ▸ | GSK3B | P49841 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 2/20 | 0.31 |
| ▸ | MAPT | P10636 | 2/20 | 0.31 |
| ▸ | GAA | P10253 | 2/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | CA12 | O43570 | 1/20 | 0.31 |
| ▸ | GMNN | O75496 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL29185542 | 0.81 | PTPN22 (0.40) | COMTALDH1A1HPGDMEN1KMT2A | |
| Methyl Alcohol SCHEMBL29113542 | 0.76 | NOX1 (0.36) | NOTUMHSD17B3MEN1KMT2ANOX1 | |
| SCHEMBL11995114 | 0.73 | SIGMAR1 (0.39) | COMTNOTUMALDH1A1HPGDHSD17B3 | |
| SCHEMBL16470043 | 0.71 | HSD17B10 (0.42) | NOTUMALDH1A1HPGDMEN1KMT2A | |
| SCHEMBL28004488 | 0.70 | NOTUM (0.34) | NOTUMKDM4E | |
| SCHEMBL27992672 | 0.70 | ALDH1A1 (0.41) | NOTUMALDH1A1HPGDHSD17B3MEN1 | |
| SCHEMBL16470683 | 0.70 | MEN1 (0.50) | NOTUMALDH1A1MEN1KMT2ANOX1 | |
| SCHEMBL22208995 | 0.70 | ADAMTS4 (0.31) | ALDH1A1HPGDHSD17B3EGFRCA2 | |
| SCHEMBL2513920 | 0.69 | NOTUM (0.42) | COMTNOTUMALDH1A1HPGDHSD17B3 | |
| SCHEMBL617743 | 0.68 | CA2 (0.44) | COMTNOTUMMAPTCA12CA2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105086998-B | A kind of lysosome targeting hypochlorous acid fluorescence probe and its preparation method and application | 济南大学 | 2017-03-29 | — | — | CN | claimed |
| CN-105086998-A | Lysosome targeted fluorescence probe for detecting hypochlorous acid molecules, as well as preparations method and application thereof | UNIV JINAN | 2015-11-25 | — | — | CN | disclosed |