Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.33 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.33 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.33 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.31 |
| ▸ | IDO1 | P14902 | 1/20 | 0.31 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL28879903 | 0.79 | ERN1 (0.36) | ERN1IDO1 | |
| SCHEMBL2561411 | 0.79 | SRC (0.42) | — | |
| SCHEMBL31176234 | 0.79 | SRC (0.42) | — | |
| SCHEMBL13062514 | 0.79 | NOS3 (0.38) | KDM5AKDM4CKDM5BRAPGEF4IDO1 | |
| SCHEMBL7451651 | 0.76 | HDAC3 (0.39) | ERN1IDO1 | |
| SCHEMBL2223090 | 0.76 | PYCR1 (0.44) | ERN1KDM5AKDM4CKDM5B | |
| SCHEMBL1922844 | 0.76 | ESR2 (0.42) | — | |
| SCHEMBL2562083 | 0.76 | P2RX7 (0.38) | KDM5AKDM4CKDM5BIDO1 | |
| SCHEMBL13985969 | 0.76 | ERN1 (0.34) | ERN1IDO1 | |
| SCHEMBL9566566 | 0.76 | ALDH1A1 (0.46) | — |
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-0570706-A1 | Aryl and heteroaryl (phosphinylmethyl) phosphonate squalene synthetase inhibitors and method | E.R. SQUIBB & SONS, INC. (US) | 1993-11-24 | — | — | EP | disclosed |