Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | RAPGEF4 | Q8WZA2 | 1/20 | 0.34 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.34 |
| ▸ | HTR6 | P50406 | 2/20 | 0.33 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | F12 | P00748 | 1/20 | 0.31 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | LMNA | P02545 | 1/20 | 0.31 |
| ▸ | TP53 | P04637 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| SCHEMBL27362602 | 0.81 | HTR6 (0.50) | TSHRHTR6 | |
| SCHEMBL1188671 | 0.81 | RAPGEF4 (0.53) | RAPGEF4MAPTGAASIGMAR1MEN1 | |
| SCHEMBL630874 | 0.79 | MEN1 (0.42) | NPSR1MAPTGAAMEN1ALDH1A1 | |
| SCHEMBL10388288 | 0.78 | SIGMAR1 (0.47) | RAPGEF4HTR6MAPTGAASIGMAR1 | |
| SCHEMBL7528041 | 0.75 | CA1 (0.39) | — | |
| SCHEMBL7351050 | 0.75 | HDAC4 (0.44) | HTR6 | |
| SCHEMBL5543430 | 0.74 | LPL (0.47) | — | |
| SCHEMBL57436 | 0.74 | MEN1 (0.53) | TSHRMAPTGAAMEN1ALDH1A1 | |
| SCHEMBL16230165 | 0.74 | TSHR (0.42) | TSHRRAPGEF4NPSR1HTR6MAPT | |
| SCHEMBL6535170 | 0.73 | ALDH1A1 (0.48) | TSHRNPSR1HTR6MAPTGAA |
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 |
|---|---|---|---|---|---|---|---|
| EP-1189891-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION Bioscience AG (DE) | 2002-03-27 | — | — | EP | claimed |
| WO-2001000594-A1 | TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF | LION BIOSCIENCE AG (DE) | 2001-01-04 | — | — | WO | claimed |