Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.40 |
| ▸ | HBB | P68871 | 2/20 | 0.40 |
| ▸ | PNP | P00491 | 2/20 | 0.40 |
| ▸ | USP2 | O75604 | 1/20 | 0.40 |
| ▸ | EDNRA | P25101 | 1/20 | 0.40 |
| ▸ | HTR2A | P28223 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | TKT | P29401 | 1/20 | 0.36 |
| ▸ | JAK3 | P52333 | 2/20 | 0.32 |
| ▸ | JAK1 | P23458 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.31 |
| ▸ | AURKA | O14965 | 1/20 | 0.31 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.31 |
| ▸ | CDK2 | P24941 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL9845279 | 0.86 | MEN1 (0.39) | TSHRHBBMEN1KMT2ATKT | |
| SCHEMBL9845272 | 0.84 | CYP3A4 (0.35) | TSHRMEN1KMT2ATKT | |
| SCHEMBL9019796 | 0.82 | CYP3A4 (0.41) | TSHRBLMMEN1KMT2ATKT | |
| SCHEMBL9845278 | 0.79 | SYK (0.31) | TSHRMEN1KMT2A | |
| SCHEMBL9019826 | 0.77 | ALDH1A1 (0.37) | TSHRBLMHSD17B10MEN1KMT2A | |
| SCHEMBL9019807 | 0.77 | PDE3A (0.32) | BLMMEN1KMT2ATKT | |
| SCHEMBL9019764 | 0.77 | PDE3A (0.38) | BLMMEN1KMT2ATKT | |
| SCHEMBL8179334 | 0.77 | TSHR (0.38) | TSHRHSD17B10MEN1KMT2AMAPK1 | |
| SCHEMBL8172851 | 0.75 | RXFP1 (0.42) | TSHRUSP2BLMTKTMAPK1 | |
| SCHEMBL9019831 | 0.74 | BCHE (0.38) | TSHRBLMMEN1KMT2ACYP1A2 |
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-0452680-A1 | Substituted purines, process for their preparation and their use as antiviral agents | HOECHST AKTIENGESELLSCHAFT (DE) | 1991-10-23 | — | — | EP | disclosed |