Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.65 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.48 |
| ▸ | HTT | P42858 | 1/20 | 0.47 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.47 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.46 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.45 |
| ▸ | RAB9A | P51151 | 2/20 | 0.45 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.44 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | TP53 | P04637 | 1/20 | 0.43 |
| ▸ | GLA | P06280 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL13718488 | 0.88 | TSHR (0.84) | TSHRHSD17B10HTTNPSR1HDAC3 | |
| SCHEMBL13718890 | 0.79 | TSHR (0.56) | TSHRHSD17B10HTTNPSR1HDAC3 | |
| SCHEMBL13718816 | 0.77 | TSHR (0.54) | TSHRHSD17B10HTTNPSR1HDAC3 | |
| SCHEMBL14062609 | 0.75 | ESR1 (0.52) | TSHR | |
| SCHEMBL13718432 | 0.71 | TSHR (0.74) | TSHRHSD17B10HTTNPSR1HDAC3 | |
| SCHEMBL14210116 | 0.70 | HPGD (0.50) | TSHRHSD17B10HTTHDAC3HDAC8 | |
| SCHEMBL28328422 | 0.70 | TSHR (0.72) | TSHRHSD17B10HTTHDAC8HDAC6 | |
| SCHEMBL45806 | 0.69 | TSHR (0.66) | TSHRHSD17B10HTTNPSR1HDAC3 | |
| SCHEMBL22482890 | 0.68 | TSHR (0.68) | TSHRHSD17B10NPSR1HDAC3HDAC8 | |
| SCHEMBL3189958 | 0.68 | HPGD (0.61) | HTTMEN1KMT2AKDM4EGAA |
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-1044364-B1 | METHOD FOR THE QUANTIFICATION OF SOLID-PHASE REACTIONS USING FLUORINE NMR | AVENTIS PHARM PROD INC (US) | 2007-06-13 | — | — | EP | disclosed |