Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.42 |
| ▸ | CAMK2A | Q9UQM7 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.39 |
| ▸ | RAB9A | P51151 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21249722 | 0.89 | ALDH1A1 (0.50) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL14723177 | 0.87 | L3MBTL1 (0.50) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL3083874 | 0.87 | ALDH1A1 (0.52) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL21249723 | 0.83 | ALDH1A1 (0.60) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL23051104 | 0.82 | ALDH1A1 (0.44) | ALDH1A1FFAR1HDAC3HDAC4HDAC1 | |
| SCHEMBL10504820 | 0.82 | CES2 (0.52) | ALDH1A1FFAR1KDM4EGAALMNA | |
| SCHEMBL27584022 | 0.81 | ALDH1A1 (0.47) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL4102385 | 0.80 | FFAR1 (0.46) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL14276946 | 0.80 | ALDH1A1 (0.47) | ALDH1A1FFAR1MAPTHDAC3HDAC4 | |
| SCHEMBL23352599 | 0.79 | ALDH1A1 (0.46) | ALDH1A1FFAR1MAPTHDAC3HDAC4 |
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-2021041583-A1 | COMPOUNDS TO IDENTIFY BETA-LACTAMASES, AND METHODS OF USE THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2021-03-04 | — | — | WO | disclosed |