Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.49 |
| ▸ | TP53 | P04637 | 2/20 | 0.48 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.47 |
| ▸ | POLB | P06746 | 2/20 | 0.47 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.47 |
| ▸ | NAMPT | P43490 | 1/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL8308357 | 0.89 | KDM4E (0.60) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8308428 | 0.83 | ALDH1A1 (0.56) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8308425 | 0.81 | ALDH1A1 (0.55) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8307004 | 0.81 | ALDH1A1 (0.53) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8308180 | 0.79 | TSHR (0.52) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8312633 | 0.79 | ALDH1A1 (0.69) | ALDH1A1KMT2ATP53MAPTNAMPT | |
| SCHEMBL8312194 | 0.78 | ALDH1A1 (0.58) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8307000 | 0.78 | KDM4E (0.61) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8304644 | 0.78 | LMNA (0.66) | ALDH1A1KMT2ATP53MAPTKDM4E | |
| SCHEMBL8311503 | 0.77 | ALDH1A1 (0.57) | ALDH1A1KMT2ATP53MAPTNAMPT |
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 |