Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.77 |
| ▸ | HTT | P42858 | 2/20 | 0.77 |
| ▸ | BACE1 | P56817 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | GAA | P10253 | 3/20 | 0.57 |
| ▸ | LMNA | P02545 | 1/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.55 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 1/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.54 |
| ▸ | ATM | Q13315 | 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 | |
|---|---|---|---|---|
| SCHEMBL17308406 | 0.89 | KDM4E (0.62) | KDM4EHTTBACE1TP53GAA | |
| SCHEMBL17308407 | 0.88 | KDM4E (0.61) | KDM4EHTTBACE1TP53GAA | |
| SCHEMBL17308400 | 0.88 | KDM4E (0.61) | KDM4EHTTBACE1TP53GAA | |
| SCHEMBL8312639 | 0.84 | TP53 (0.64) | KDM4EHTTBACE1TP53GAA | |
| SCHEMBL8309383 | 0.83 | TP53 (0.66) | KDM4EHTTBACE1TP53GAA | |
| SCHEMBL8312044 | 0.83 | KDM4E (0.79) | KDM4EHTTBACE1TP53LMNA | |
| SCHEMBL8307503 | 0.83 | KDM4E (0.62) | KDM4EHTTGAAALDH1A1MAPT | |
| SCHEMBL8312207 | 0.82 | KDM4E (0.80) | KDM4EHTTBACE1TP53LMNA | |
| SCHEMBL8308227 | 0.82 | KDM4E (0.84) | KDM4EHTTBACE1TP53LMNA | |
| SCHEMBL8308783 | 0.82 | TP53 (0.75) | KDM4EHTTBACE1TP53LMNA |
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 |