Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.36 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 5/20 | 0.33 |
| ▸ | TSHR | P16473 | 2/20 | 0.33 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.32 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.32 |
| ▸ | LTA4H | P09960 | 1/20 | 0.31 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.31 |
| ▸ | DHFR | P00374 | 1/20 | 0.31 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.31 |
| ▸ | AGER | Q15109 | 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 | |
|---|---|---|---|---|
| SCHEMBL9575400 | 0.85 | KDM4E (0.46) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL9575441 | 0.85 | RPS6KA3 (0.35) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL9575793 | 0.82 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL10997155 | 0.77 | HDAC6 (0.43) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| Rociclovir SCHEMBL1228859 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| Rociclovir SCHEMBL29573658 | 0.76 | ALDH1A1 (0.49) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL11957470 | 0.73 | TSHR (0.40) | ALDH1A1HPGDCYP1A2TSHRCYP2C19 | |
| SCHEMBL10996224 | 0.72 | ALDH1A1 (0.52) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 | |
| SCHEMBL11294401 | 0.72 | HPRT1 (0.35) | CYP1A2CYP3A4CYP2C19CYP2D6CYP2C9 | |
| SCHEMBL28299548 | 0.71 | HDAC6 (0.63) | ALDH1A1KDM4EHPGDADRA1AHSD17B10 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5225550-A | PROCESS FOR THE PREPARATION OF SUBSTITUTED ACYCLIC NUCLEOSIDES, AND INTERMEDIATES OCCURRING THEREIN | HOECHST AKTIENGESELLSCHAFT (DE) | 1993-07-06 | — | — | US | disclosed |
| CN-1057652-A | A kind of acyclic nucleotide of replacement and method of related intermediates thereof of preparing | HOECHST AG (DE) | 1992-01-08 | — | — | CN | disclosed |