Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.33 |
| ▸ | HRH1 | P35367 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 7/20 | 0.33 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.32 |
| ▸ | ESR1 | P03372 | 2/20 | 0.32 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.32 |
| ▸ | ADORA3 | P0DMS8 | 2/20 | 0.32 |
| ▸ | TACR2 | P21452 | 2/20 | 0.32 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.32 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.32 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | SHBG | P04278 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL5536148 | 1.00 | KCNH2 (0.44) | KCNH2TDP1L3MBTL1HRH1CYP19A1 | |
| SCHEMBL3764874 | 0.98 | KCNH2 (0.41) | KCNH2TDP1L3MBTL1HRH1CYP19A1 | |
| SCHEMBL2252151 | 0.92 | KCNH2 (0.34) | KCNH2ESR1 | |
| SCHEMBL2252422 | 0.84 | — | — | |
| SCHEMBL1188686 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A | |
| SCHEMBL1187823 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A | |
| SCHEMBL1186843 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A | |
| SCHEMBL1189000 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A | |
| SCHEMBL1187572 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A | |
| SCHEMBL1187641 | 0.76 | KCNH2 (0.61) | KCNH2CYP19A1PTGS2ESR1ADRA2A |
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 |
|---|---|---|---|---|---|---|---|
| US-7704489-B1 | Method of photocatalytic nanotagging | SANDIA CORPORATION (US) | 2010-04-27 | — | — | US | disclosed |