Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HEXA | P06865 | 2/20 | 0.58 |
| ▸ | HEXB | P07686 | 2/20 | 0.58 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.54 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.53 |
| ▸ | MEN1 | O00255 | 2/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.53 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | LTA4H | P09960 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.53 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.53 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.53 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.53 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.53 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.53 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.53 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.53 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL10690695 | 1.00 | HEXA (0.58) | HEXAHEXBSIRT1CYP3A4NFKB1 | |
| SCHEMBL10688300 | 0.99 | HEXA (0.59) | HEXAHEXBHSD17B10MEN1KMT2A | |
| SCHEMBL10690041 | 0.96 | HEXA (0.57) | HEXAHEXBHSD17B10MEN1KMT2A | |
| SCHEMBL10687742 | 0.88 | KDM4E (0.48) | HEXAHEXBCYP3A4HSD17B10NR1I2 | |
| SCHEMBL23772131 | 0.88 | ESR1 (0.60) | HSD17B10 | |
| SCHEMBL10655149 | 0.88 | ESR1 (0.60) | HSD17B10 | |
| SCHEMBL10832761 | 0.88 | ESR1 (0.60) | HSD17B10 | |
| SCHEMBL10839307 | 0.88 | ESR1 (0.60) | HSD17B10 | |
| SCHEMBL13207604 | 0.86 | CYP1B1 (0.51) | HEXAHEXBHSD17B10MEN1KMT2A | |
| Hydrochloric Acid SCHEMBL10836501 | 0.86 | ESR1 (0.58) | HSD17B10 |
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-4782064-A | THROMBOXANE SYNTHETASE INHIBITORS | AMERICAN CYANAMID CO. (US) | 1988-11-01 | — | — | US | claimed |