Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.45 |
| ▸ | HPGD | P15428 | 5/20 | 0.45 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.45 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | GLA | P06280 | 1/20 | 0.45 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 1/20 | 0.41 |
| ▸ | POLA1 | P09884 | 2/20 | 0.40 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.40 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.39 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.39 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | JAK2 | O60674 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL7841512 | 0.94 | ALDH1A1 (0.46) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6673044 | 0.85 | ALDH1A1 (0.61) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6959107 | 0.82 | ALDH1A1 (0.47) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6670610 | 0.81 | ALDH1A1 (0.42) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6667428 | 0.80 | ALDH1A1 (0.51) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL7199782 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6701498 | 0.79 | ALDH1A1 (0.43) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6957798 | 0.79 | ALDH1A1 (0.45) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6668351 | 0.79 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4EGAAGLA | |
| SCHEMBL6964935 | 0.79 | ALDH1A1 (0.44) | ALDH1A1HPGDKDM4EGAAGLA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1140850-A1 | QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2001-10-10 | — | — | EP | disclosed |
| WO-2000040561-A1 | QUINOLINECARBOXAMIDES AS ANTIVIRAL AGENTS | PHARMACIA & UPJOHN COMPANY (US) | 2000-07-13 | — | — | WO | disclosed |