Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.74 |
| ▸ | BACE1 | P56817 | 3/20 | 0.70 |
| ▸ | TSHR | P16473 | 1/20 | 0.66 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.58 |
| ▸ | HPGD | P15428 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.56 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | GAA | P10253 | 1/20 | 0.55 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.55 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL8308904 | 0.92 | BACE1 (0.72) | KDM4EALDH1A1BACE1TSHRKMT2A | |
| SCHEMBL8311935 | 0.91 | BACE1 (0.71) | KDM4EALDH1A1BACE1TSHRKMT2A | |
| SCHEMBL8312229 | 0.91 | BACE1 (0.71) | KDM4EALDH1A1BACE1TSHRKMT2A | |
| SCHEMBL8305724 | 0.84 | BACE1 (0.73) | KDM4EALDH1A1BACE1KMT2AHPGD | |
| SCHEMBL8304358 | 0.84 | BACE1 (0.65) | KDM4EALDH1A1BACE1TSHRKMT2A | |
| SCHEMBL8311945 | 0.84 | BACE1 (0.72) | KDM4EALDH1A1BACE1KMT2AHPGD | |
| SCHEMBL8308103 | 0.84 | BACE1 (0.72) | KDM4EALDH1A1BACE1KMT2AHPGD | |
| SCHEMBL8306905 | 0.83 | KDM4E (0.65) | KDM4EALDH1A1BACE1PKMKMT2A | |
| SCHEMBL8311201 | 0.83 | HSD17B10 (0.66) | KDM4EALDH1A1BACE1PKMKMT2A | |
| SCHEMBL8304133 | 0.83 | BACE1 (0.69) | KDM4EALDH1A1BACE1KMT2ATP53 |
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 |