Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.48 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.48 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.48 |
| ▸ | CSNK1D | P48730 | 1/20 | 0.48 |
| ▸ | GSK3B | P49841 | 1/20 | 0.48 |
| ▸ | CSNK1G2 | P78368 | 1/20 | 0.48 |
| ▸ | CCR6 | P51684 | 1/20 | 0.46 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | TRPV4 | Q9HBA0 | 1/20 | 0.45 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.45 |
| ▸ | GRM5 | P41594 | 1/20 | 0.44 |
| ▸ | HAO1 | Q9UJM8 | 1/20 | 0.44 |
| ▸ | ABCG2 | Q9UNQ0 | 3/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | DHODH | Q02127 | 1/20 | 0.42 |
| ▸ | CDK1 | P06493 | 1/20 | 0.42 |
| ▸ | KDR | P35968 | 1/20 | 0.42 |
| ▸ | CCNK | O75909 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL27303096 | 0.84 | GRM5 (0.46) | ALDH1A1CYP2A6CCR6TRPV4GRM5 | |
| SCHEMBL27295837 | 0.83 | MEN1 (0.51) | TRPV4GRM5ABCG2DHODHLMNA | |
| SCHEMBL31473409 | 0.83 | MEN1 (0.51) | TRPV4GRM5ABCG2DHODHLMNA | |
| SCHEMBL10549553 | 0.83 | ABCG2 (0.53) | ALDH1A1GSK3BABCG2KDM4EGAA | |
| SCHEMBL11563207 | 0.80 | HAO1 (0.53) | GRM5HAO1KDR | |
| SCHEMBL22265881 | 0.78 | HPGD (0.53) | ALDH1A1ABCG2KDM4EL3MBTL1LMNA | |
| SCHEMBL10694580 | 0.78 | ALDH1A1 (0.73) | ALDH1A1CYP2A6CSNK1A1CSNK1DGSK3B | |
| SCHEMBL22265747 | 0.76 | HSD17B10 (0.56) | ALDH1A1ABCG2KDM4EL3MBTL1GAA | |
| SCHEMBL27297664 | 0.76 | IDH1 (0.42) | SLC2A1TRPV4ABCG2CCNKCCNA2 | |
| SCHEMBL27834535 | 0.75 | CCNK (0.55) | CSNK1A1CSNK1DCSNK1G2CCNKCCNA2 |
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-2020154431-A1 | INHIBITORS OF SPINSTER HOMOLOG 2 (SPNS2) FOR USE IN THERAPY | LYNCH KEVIN R (US) | 2020-07-30 | — | — | WO | disclosed |