Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.44 |
| ▸ | NQO2 | P16083 | 2/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | CRHBP | P24387 | 1/20 | 0.36 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.36 |
| ▸ | LCK | P06239 | 1/20 | 0.36 |
| ▸ | ACHE | P22303 | 1/20 | 0.35 |
| ▸ | CA12 | O43570 | 4/20 | 0.33 |
| ▸ | CA9 | Q16790 | 4/20 | 0.33 |
| ▸ | CA2 | P00918 | 3/20 | 0.33 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.33 |
| ▸ | CA1 | P00915 | 3/20 | 0.33 |
| ▸ | CA7 | P43166 | 2/20 | 0.33 |
| ▸ | CA5A | P35218 | 2/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.33 |
| ▸ | HDAC6 | Q9UBN7 | 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 | |
|---|---|---|---|---|
| SCHEMBL5681632 | 0.94 | BACE1 (0.41) | BACE1LMNANQO2CYP3A4HSD17B10 | |
| SCHEMBL31579242 | 0.73 | BACE1 (0.57) | BACE1LMNANQO2CYP3A4HSD17B10 | |
| SCHEMBL5161748 | 0.73 | — | — | |
| Phloroglucinol SCHEMBL2889628 | 0.71 | BACE1 (1.00) | BACE1LMNANQO2CYP3A4HSD17B10 | |
| Phloroglucinol SCHEMBL26311 | 0.71 | — | — | |
| Phloroglucinol SCHEMBL30542958 | 0.71 | — | — | |
| SCHEMBL28923201 | 0.69 | BACE1 (0.50) | BACE1LMNANQO2CYP3A4HSD17B10 | |
| SCHEMBL128139 | 0.69 | LMNA (0.50) | BACE1LMNANQO2CYP3A4HSD17B10 | |
| SCHEMBL1129102 | 0.69 | — | — | |
| Phloroglucinol SCHEMBL23346245 | 0.67 | BACE1 (0.89) | BACE1LMNANQO2CYP3A4HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| US-9115164-B2 | Substituted aromatic compound, hydrogelation agent, hydrogel, and method for gelating aqueous sample | NATIONAL UNIVERSITY CORPORATION SHIZUOKA UNIVERSITY (JP) | 2015-08-25 | — | — | US | disclosed |