Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | ESR1 | P03372 | 1/20 | 0.39 |
| ▸ | NR3C1 | P04150 | 1/20 | 0.39 |
| ▸ | PGR | P06401 | 1/20 | 0.39 |
| ▸ | NR3C2 | P08235 | 1/20 | 0.39 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
| ▸ | TAOK1 | Q7L7X3 | 2/20 | 0.37 |
| ▸ | TAOK3 | Q9H2K8 | 2/20 | 0.37 |
| ▸ | HRH3 | Q9Y5N1 | 2/20 | 0.37 |
| ▸ | THRB | P10828 | 1/20 | 0.37 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.37 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL5011798 | 0.88 | TSHR (0.41) | TSHRSMN1; SMN2LMNAALDH1A1HTT | |
| SCHEMBL5011597 | 0.80 | PLAAT3 (0.41) | SMN1; SMN2LMNAALDH1A1EPHX2 | |
| SCHEMBL4272713 | 0.75 | TSHR (0.45) | TSHRSMN1; SMN2ERN1ALDH1A1HPGD | |
| SCHEMBL5013516 | 0.74 | RAB9A (0.46) | SMN1; SMN2LMNAALDH1A1NPSR1HPGD | |
| SCHEMBL1086318 | 0.67 | ERN1 (0.54) | TSHRSMN1; SMN2ERN1LMNAALDH1A1 | |
| SCHEMBL5012256 | 0.65 | TP53 (0.46) | TSHRLMNAALDH1A1THRBCHRM1 | |
| SCHEMBL9659041 | 0.65 | TSHR (1.00) | TSHRSMN1; SMN2LMNAALDH1A1HPGD | |
| SCHEMBL5013344 | 0.65 | CNR2 (0.38) | TSHRSMN1; SMN2LMNAALDH1A1HTT | |
| SCHEMBL5351946 | 0.64 | CHRM2 (0.50) | SMN1; SMN2ERN1ALDH1A1HTTNPSR1 | |
| SCHEMBL7616443 | 0.64 | LMNA (0.65) | TSHRSMN1; SMN2LMNAALDH1A1HTT |
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 |