Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 8/20 | 0.39 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.33 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.33 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.33 |
| ▸ | CHRM3 | P20309 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.33 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.33 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | DBH | P09172 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | RECQL | P46063 | 1/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL10166229 | 0.86 | HDAC6 (0.51) | HDAC6PTGS1PTGS2HDAC1GAA | |
| SCHEMBL19154811 | 0.75 | HDAC6 (0.48) | HDAC6PTGS1PTGS2HRH3CHRM2 | |
| SCHEMBL4550732 | 0.70 | HDAC6 (0.54) | HDAC6PTGS1PTGS2HRH3HDAC1 | |
| SCHEMBL19154945 | 0.69 | HDAC6 (0.53) | HDAC6PTGS1PTGS2HDAC1GAA | |
| SCHEMBL15187769 | 0.68 | HDAC6 (0.64) | HDAC6HRH3HDAC1HDAC4 | |
| SCHEMBL7495940 | 0.65 | KDM4E (0.47) | HDAC6HRH3CHRM2CYP2D6ADRA2B | |
| SCHEMBL22249514 | 0.65 | CA1 (0.55) | HDAC6HRH3CHRM2CYP2D6ADRA2B | |
| SCHEMBL23517991 | 0.65 | HPGD (0.40) | HDAC6HDAC1KDM4EGAAHDAC4 | |
| SCHEMBL3685675 | 0.65 | KDM4E (0.50) | HRH3CHRM2CYP2D6ADRA2BADRA2C | |
| SCHEMBL480603 | 0.65 | KMT2A (0.58) | HDAC6PTGS2HRH3CHRM2CYP2D6 |
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-8409807-B2 | NMR systems and methods for the rapid detection of analytes | T2 BIOSYSTEMS, INC. (US) | 2013-04-02 | — | — | US | disclosed |
| US-20120164644-A1 | NMR SYSTEMS AND METHODS FOR THE RAPID DETECTION OF ANALYTES | T2 BIOSYSTEMS, INC. (US) | 2012-06-28 | — | — | US | disclosed |