Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 6/20 | 0.41 |
| ▸ | AURKA | O14965 | 5/20 | 0.41 |
| ▸ | MET | P08581 | 4/20 | 0.41 |
| ▸ | TEK | Q02763 | 4/20 | 0.41 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.41 |
| ▸ | PARP1 | P09874 | 5/20 | 0.40 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.40 |
| ▸ | ABL1 | P00519 | 1/20 | 0.40 |
| ▸ | LCK | P06239 | 1/20 | 0.40 |
| ▸ | LYN | P07948 | 1/20 | 0.40 |
| ▸ | PLG | P00747 | 1/20 | 0.39 |
| ▸ | F12 | P00748 | 1/20 | 0.39 |
| ▸ | F11 | P03951 | 1/20 | 0.39 |
| ▸ | KLKB1 | P03952 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL12801478 | 0.85 | PTPN1 (0.62) | KDM4EALDH1A1CA1CA2PTPN1 | |
| SCHEMBL634882 | 0.79 | KDM4E (0.65) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL29463701 | 0.77 | ALDH1A1 (0.62) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL1807859 | 0.77 | KDM4E (0.62) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL6384957 | 0.77 | ALDH1A1 (0.62) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL1807858 | 0.77 | KDM4E (0.62) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL10274480 | 0.76 | KDM4E (0.61) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL14937023 | 0.76 | ALDH1A1 (0.61) | KDM4EALDH1A1GAAPTPN1KDR | |
| SCHEMBL29957738 | 0.75 | CA1 (0.53) | KDM4EALDH1A1GAACA1CA2 | |
| SCHEMBL17749168 | 0.75 | KDR (0.49) | KDM4EALDH1A1KDRAURKAMET |
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-2013033270-A2 | BROMODOMAIN LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME | COFERON, INC. (US) | 2013-03-07 | — | — | WO | disclosed |