Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 3/20 | 0.71 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.68 |
| ▸ | HPGD | P15428 | 5/20 | 0.68 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.68 |
| ▸ | GAA | P10253 | 1/20 | 0.68 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.65 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | MEN1 | O00255 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | TP53 | P04637 | 2/20 | 0.52 |
| ▸ | USP2 | O75604 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL8305955 | 0.85 | ALDH1A1 (0.68) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8312039 | 0.84 | BACE1 (0.98) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8306046 | 0.83 | BACE1 (0.84) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8311972 | 0.83 | BACE1 (1.00) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8312192 | 0.83 | KDM4E (0.56) | BACE1KDM4EHPGDHSD17B10ALDH1A1 | |
| SCHEMBL8312648 | 0.82 | KDM4E (0.58) | BACE1KDM4EHPGDHSD17B10ALDH1A1 | |
| SCHEMBL8311813 | 0.82 | KDM4E (0.58) | BACE1KDM4EHPGDHSD17B10ALDH1A1 | |
| SCHEMBL8305872 | 0.82 | BACE1 (0.91) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8312512 | 0.81 | ALDH1A1 (0.56) | BACE1KDM4EHPGDHSD17B10GAA | |
| SCHEMBL8303951 | 0.81 | BACE1 (0.89) | BACE1KDM4EHPGDALDH1A1KMT2A |
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-2004078731-A1 | QUINOLINE-CARBOXYLIC ACIDS AND THE DERIVATIVES THEREOF, A FOCUSED LIBRARY | 'CHEMICAL DIVERSITY RESEARCH INSTITUTE', LTD. (RU) | 2004-09-16 | — | — | WO | disclosed |