Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 4/20 | 0.39 |
| ▸ | HTT | P42858 | 4/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.39 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.38 |
| ▸ | PDE5A | O76074 | 1/20 | 0.38 |
| ▸ | PDE4A | P27815 | 1/20 | 0.38 |
| ▸ | PDE4B | Q07343 | 1/20 | 0.38 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.38 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 4/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | PDE6D | O43924 | 2/20 | 0.37 |
| ▸ | RECQL | P46063 | 2/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18834221 | 0.91 | P2RX3 (0.40) | ALDH1A1NPSR1HTTHPGDSMN1; SMN2 | |
| SCHEMBL19375519 | 0.81 | PDE5A (0.31) | P2RX7PDE5APDE4APDE4BPDE4C | |
| SCHEMBL20432418 | 0.77 | ALDH1A1 (0.47) | ALDH1A1NPSR1HTTHPGDSMN1; SMN2 | |
| SCHEMBL18834196 | 0.73 | ALDH1A1 (0.40) | ALDH1A1NPSR1HTTMAPTPDE5A | |
| SCHEMBL18834317 | 0.72 | MEN1 (0.45) | ALDH1A1HPGDSMN1; SMN2P2RX7PDE5A | |
| SCHEMBL21316344 | 0.70 | P2RX3 (0.40) | ALDH1A1NPSR1HTTHPGDSMN1; SMN2 | |
| SCHEMBL18833638 | 0.69 | USP1 (0.38) | ALDH1A1HTTSMN1; SMN2MAPTMEN1 | |
| SCHEMBL19374868 | 0.69 | P2RX3 (0.36) | P2RX7LMNAL3MBTL1TSHRBRD4 | |
| SCHEMBL18834418 | 0.68 | TP53 (0.49) | ALDH1A1HTTHPGDSMN1; SMN2MAPT | |
| SCHEMBL8007895 | 0.67 | PDE5A (0.39) | ALDH1A1HPGDPDE5AMEN1KMT2A |
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-2970303-B9 | SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF | HYDRA BIOSCIENCES INC (US) | 2017-09-20 | — | — | EP | disclosed |