Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.57 |
| ▸ | TP53 | P04637 | 4/20 | 0.56 |
| ▸ | RXFP1 | Q9HBX9 | 2/20 | 0.55 |
| ▸ | BACE1 | P56817 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 3/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.48 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.48 |
| ▸ | POLB | P06746 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8305720 | 0.92 | RXFP1 (0.58) | TP53RXFP1BACE1MAPTLMNA | |
| SCHEMBL8305992 | 0.91 | RXFP1 (0.66) | TP53RXFP1BACE1MAPTMEN1 | |
| SCHEMBL8308106 | 0.86 | TP53 (0.58) | TP53BACE1MEN1KMT2APOLB | |
| SCHEMBL8305695 | 0.85 | TP53 (0.65) | TP53RXFP1BACE1MAPTMEN1 | |
| SCHEMBL8305991 | 0.84 | KDM4E (0.60) | KDM4ETP53RXFP1BACE1MAPT | |
| SCHEMBL8305815 | 0.84 | KDM4E (0.62) | KDM4ETP53BACE1MAPTLMNA | |
| SCHEMBL8305716 | 0.84 | KDM4E (0.62) | KDM4ETP53BACE1MAPTLMNA | |
| SCHEMBL8305884 | 0.82 | TP53 (0.49) | KDM4ETP53BACE1MAPTLMNA | |
| SCHEMBL8308354 | 0.82 | KDM4E (0.51) | KDM4ETP53BACE1MAPTLMNA | |
| SCHEMBL8308357 | 0.81 | KDM4E (0.60) | KDM4ETP53RXFP1MAPTLMNA |
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 |