Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 4/20 | 0.37 |
| ▸ | GRIN2B | Q13224 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | CTSS | P25774 | 2/20 | 0.35 |
| ▸ | ALOX5AP | P20292 | 1/20 | 0.35 |
| ▸ | FEN1 | P39748 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.34 |
| ▸ | CTSK | P43235 | 1/20 | 0.34 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23543364 | 0.97 | XDH (0.41) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL20834366 | 0.93 | XDH (0.42) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL20834491 | 0.93 | GRIN1 (0.38) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL23543372 | 0.92 | XDH (0.41) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL23679172 | 0.92 | XDH (0.36) | XDHGRIN1GRIN2BALOX5APFEN1 | |
| SCHEMBL23543371 | 0.92 | GRIN1 (0.39) | XDHGRIN1GRIN2BCTSSPDPK1 | |
| SCHEMBL23543383 | 0.92 | GRIN1 (0.42) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL23543319 | 0.91 | XDH (0.37) | XDHALOX5APFEN1PDPK1GABRA1 | |
| SCHEMBL20834367 | 0.90 | GRIN1 (0.39) | XDHGRIN1GRIN2BKDM4ECTSS | |
| SCHEMBL20834490 | 0.90 | ABCG2 (0.37) | XDHGRIN1GRIN2BKDM4ECTSS |
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-2019053049-A1 | ORGANIC MOLECULES, IN PARTICULAR FOR USE IN OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2019-03-21 | — | — | WO | disclosed |