Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADRA2A | P08913 | 2/20 | 0.54 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.54 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.54 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 7/20 | 0.42 |
| ▸ | LMNA | P02545 | 4/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | P4HTM | Q9NXG6 | 1/20 | 0.41 |
| ▸ | PLAU | P00749 | 1/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 2/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL41111 | 0.84 | ADRA2A (0.56) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL18827493 | 0.82 | CYP1A2 (0.53) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| Methane SCHEMBL28217937 | 0.82 | ADRA2A (0.54) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL27722370 | 0.79 | ADRA2A (0.51) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL17365240 | 0.78 | ADRA2A (0.46) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL9098551 | 0.78 | P4HTM (0.61) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL1403645 | 0.78 | P4HTM (0.61) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL5326143 | 0.76 | ALDH1A1 (0.53) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| SCHEMBL6163873 | 0.76 | CYP1A2 (0.58) | ADRA2AADRA2BADRA2CSLC2A1GAA | |
| Hydrochloric Acid SCHEMBL28862169 | 0.76 | P4HTM (0.60) | ADRA2AADRA2BADRA2CSLC2A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| WO-2004110351-A2 | HETEROCYCLIC COMPOUNDS FOR TREATING HEPATITIS C VIRUS | ANADYS PHARMACEUTICALS, INC. (US) | 2004-12-23 | — | — | WO | disclosed |