Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | RAPGEF4 | Q8WZA2 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 3/20 | 0.44 |
| ▸ | HTT | P42858 | 2/20 | 0.42 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.40 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | CRHBP | P24387 | 1/20 | 0.39 |
| ▸ | CRHR2 | Q13324 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL5608474 | 0.90 | HDAC8 (0.59) | ALDH1A1KDM4EPOLBRAPGEF4HDAC8 | |
| SCHEMBL82947 | 0.87 | BRD4 (0.48) | ALDH1A1KDM4EPOLBRAPGEF4HDAC8 | |
| Hydrochloric Acid SCHEMBL69124 | 0.86 | BRD4 (0.47) | ALDH1A1KDM4EPOLBRAPGEF4HDAC8 | |
| SCHEMBL12327879 | 0.82 | GLA (0.48) | ALDH1A1KDM4EPOLBRAPGEF4GAA | |
| SCHEMBL30657543 | 0.80 | KDM4E (0.46) | ALDH1A1KDM4EPOLBRAPGEF4GAA | |
| SCHEMBL20345722 | 0.80 | KDM4E (0.46) | ALDH1A1KDM4EPOLBRAPGEF4GAA | |
| SCHEMBL28791583 | 0.79 | MEN1 (0.48) | HDAC8GAATP53 | |
| SCHEMBL2637117 | 0.78 | MEN1 (0.47) | HDAC8GAATP53 | |
| SCHEMBL30777245 | 0.77 | P2RX7 (0.44) | ALDH1A1KDM4EPOLBHDAC8GAA | |
| SCHEMBL16418620 | 0.77 | HDAC8 (0.43) | ALDH1A1KDM4EPOLBHDAC8HTT |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1354887-B1 | Ligands for metals and improved metal-catalyzed processes based thereon | MASSACHUSETTS INST TECHNOLOGY (US) | 2007-04-25 | — | — | EP | disclosed |
| EP-1097158-B1 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INST TECHNOLOGY (US) | 2006-01-25 | — | — | EP | disclosed |
| EP-1354887-A1 | Ligands for metals and improved metal-catalyzed processes based thereon | Massachusetts Insitute of Technology (US) | 2003-10-22 | — | — | EP | disclosed |
| EP-1097158-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2001-05-09 | — | — | EP | disclosed |
| WO-2000002887-A2 | LIGANDS FOR METALS AND METAL-CATALYZED PROCESSES | MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) | 2000-01-20 | — | — | WO | disclosed |