Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1B1 | P15121 | 9/20 | 0.83 |
| ▸ | PTPN1 | P18031 | 7/20 | 0.83 |
| ▸ | MMP3 | P08254 | 3/20 | 0.83 |
| ▸ | MMP13 | P45452 | 3/20 | 0.83 |
| ▸ | MEN1 | O00255 | 5/20 | 0.79 |
| ▸ | POLB | P06746 | 5/20 | 0.79 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.79 |
| ▸ | GFER | P55789 | 2/20 | 0.66 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.66 |
| ▸ | DNMT1 | P26358 | 1/20 | 0.66 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.66 |
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 | |
|---|---|---|---|---|
| SCHEMBL29408634 | 1.00 | AKR1B1 (0.83) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL1060503 | 0.91 | AKR1B1 (1.00) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL19736228 | 0.91 | AKR1B1 (1.00) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL17319262 | 0.91 | AKR1B1 (1.00) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL30228410 | 0.90 | MAPT (0.71) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL12008506 | 0.90 | MAPT (0.71) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL6886682 | 0.90 | AKR1B1 (0.83) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL25997484 | 0.90 | AKR1B1 (0.83) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL6886677 | 0.90 | AKR1B1 (0.83) | AKR1B1PTPN1MMP3MMP13MEN1 | |
| SCHEMBL19736085 | 0.88 | MEN1 (1.00) | AKR1B1PTPN1MMP3MMP13MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017215552-A1 | ANTIMICROBIAL COMPOUNDS AND METHODS FOR USE THEREOF | THE UNIVERSITY OF HONG KONG (CN) | 2017-12-21 | — | — | WO | disclosed |