Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MCL1 | Q07820 | 9/20 | 0.80 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.80 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.80 |
| ▸ | GAA | P10253 | 3/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.80 |
| ▸ | LMNA | P02545 | 2/20 | 0.80 |
| ▸ | MGAM | O43451 | 1/20 | 0.80 |
| ▸ | TP53 | P04637 | 1/20 | 0.80 |
| ▸ | MAPT | P10636 | 1/20 | 0.80 |
| ▸ | SI | P14410 | 1/20 | 0.80 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.80 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.80 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.80 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.71 |
| ▸ | AKR1B1 | P15121 | 2/20 | 0.71 |
| ▸ | HPGD | P15428 | 2/20 | 0.71 |
| ▸ | THRB | P10828 | 1/20 | 0.71 |
| ▸ | MAOB | P27338 | 4/20 | 0.61 |
| ▸ | ACE | P12821 | 1/20 | 0.60 |
| ▸ | GFER | P55789 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| 4-Methyldaphnetin SCHEMBL29671915 | 0.89 | MCL1 (1.00) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methyldaphnetin SCHEMBL1065373 | 0.89 | MCL1 (1.00) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methyldaphnetin SCHEMBL11394807 | 0.89 | MCL1 (0.64) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methylesculetin SCHEMBL409482 | 0.84 | MCL1 (1.00) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methylesculetin SCHEMBL29361762 | 0.84 | MCL1 (1.00) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methylesculetin SCHEMBL6839210 | 0.83 | MCL1 (0.96) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methylesculetin SCHEMBL27453331 | 0.83 | ALDH1A1 (0.96) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| SCHEMBL4187220 | 0.77 | MAOB (1.00) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| SCHEMBL24865598 | 0.76 | ALDH1A1 (0.82) | MCL1KDM4EALDH1A1GAACYP3A4 | |
| 4-Methylesculetin SCHEMBL7798943 | 0.75 | KDM4E (0.73) | MCL1KDM4EALDH1A1GAACYP3A4 |
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-2011043817-A1 | COFERONS AND METHODS OF MAKING AND USING THEM | CORNELL UNIVERSITY (US) | 2011-04-14 | — | — | WO | disclosed |