Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSD11B1 | P28845 | 2/20 | 0.42 |
| ▸ | IDO1 | P14902 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | HTT | P42858 | 1/20 | 0.37 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.35 |
| ▸ | CACNA1H | O95180 | 4/20 | 0.35 |
| ▸ | CACNA1G | O43497 | 2/20 | 0.35 |
| ▸ | CACNA1I | Q9P0X4 | 2/20 | 0.35 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.34 |
| ▸ | SSTR5 | P35346 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | THRB | P10828 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 1/20 | 0.34 |
| ▸ | FFAR2 | O15552 | 1/20 | 0.33 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.33 |
| ▸ | MDM2 | Q00987 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL5013535 | 0.79 | ALDH1A1 (0.39) | ALDH1A1HTTPTGDR2CACNA1HCACNA1G | |
| SCHEMBL5015096 | 0.77 | KMT2A (0.37) | ALDH1A1MEN1KMT2ASIGMAR1LMNA | |
| SCHEMBL5016389 | 0.77 | ALDH1A1 (0.35) | ALDH1A1HTTPTGDR2CACNA1HCACNA1G | |
| SCHEMBL5060789 | 0.76 | PTPN1 (0.41) | ALDH1A1SSTR5 | |
| SCHEMBL5012778 | 0.76 | TP53 (0.37) | ALDH1A1HTTKMT2ACACNA1HCACNA1G | |
| SCHEMBL5016419 | 0.75 | ALDH1A1 (0.41) | ALDH1A1HTTSIGMAR1LMNA | |
| SCHEMBL1086610 | 0.72 | HSD11B1 (0.47) | HSD11B1MEN1KMT2ASSTR5 | |
| SCHEMBL5013449 | 0.68 | KAT6A (0.39) | — | |
| SCHEMBL5011651 | 0.68 | CHRM2 (0.44) | ALDH1A1MEN1KMT2ALMNA | |
| SCHEMBL30764735 | 0.68 | HSD11B1 (0.51) | HSD11B1ALDH1A1HTTMEN1KMT2A |
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-1910381-A2 | SUBSTITUTED 1-OXA-3,8-DIAZASPIRO[4.5]-DECAN-2-ON- COMPOUNDS AND THE USE THEREOF FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2008-04-16 | — | — | EP | disclosed |
| WO-2007000325-A2 | SUBSTITUTED 1-OXA-3,8-DIAZASPIRO[4.5]-DECAN-2-ON- COMPOUNDS AND THE USE THEREOF FOR PRODUCING DRUGS | Grünenthal GmbH (DE) | 2007-01-04 | — | — | WO | disclosed |