Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.58 |
| ▸ | CCNC | P24863 | 1/20 | 0.40 |
| ▸ | CDK8 | P49336 | 1/20 | 0.40 |
| ▸ | CDK19 | Q9BWU1 | 1/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | PKM | P14618 | 3/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.35 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.34 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.34 |
| ▸ | BRD4 | O60885 | 1/20 | 0.34 |
| ▸ | OPRK1 | P41145 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL7036441 | 0.81 | MEN1 (0.64) | ALDH1A1KDM4EPOLBRXFP1KMT2A | |
| SCHEMBL7241506 | 0.78 | MEN1 (0.60) | ALDH1A1KDM4EKMT2ANPSR1MEN1 | |
| SCHEMBL4927569 | 0.78 | ALDH1A1 (0.35) | ALDH1A1KDM4EPOLBRXFP1CCNC | |
| SCHEMBL4923028 | 0.77 | ALDH1A1 (0.50) | ALDH1A1KDM4EPOLBRXFP1CCNC | |
| SCHEMBL23111587 | 0.76 | ALDH1A1 (0.35) | ALDH1A1KDM4EPOLBRXFP1KMT2A | |
| SCHEMBL2762259 | 0.76 | BRD4 (0.36) | ALDH1A1KDM4EPOLBRXFP1KMT2A | |
| Hydrochloric Acid SCHEMBL4930234 | 0.75 | ALDH1A1 (0.49) | ALDH1A1KDM4EPOLBRXFP1CCNC | |
| SCHEMBL1060812 | 0.74 | KDM4E (1.00) | ALDH1A1KDM4EPOLBRXFP1CCNC | |
| SCHEMBL23111682 | 0.72 | PTGS2 (0.48) | ALDH1A1KDM4EPOLBRXFP1KMT2A | |
| SCHEMBL4926446 | 0.71 | ADORA2A (0.42) | ALDH1A1KDM4EKMT2ANPSR1MEN1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1293197-A1 | PROCESS FOR PRODUCING PHOSPHOLIPID-CONTAINING DRUGS | Takeda Chemical Industries, Ltd. (JP) | 2003-03-19 | — | — | EP | disclosed |