Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2A6 | P11509 | 3/20 | 0.33 |
| ▸ | ASIC3 | Q9UHC3 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.31 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.31 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.31 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL6346209 | 0.98 | CYP2A6 (0.32) | CYP2A6ASIC3LOXL2MEN1ALDH1A1 | |
| SCHEMBL16863718 | 0.82 | ALDH1A1 (0.33) | CYP2A6MEN1ALDH1A1MAPTHPGD | |
| SCHEMBL25363789 | 0.80 | CYP2A6 (0.33) | CYP2A6TSHR | |
| Hydrochloric Acid SCHEMBL25366109 | 0.78 | CYP2A6 (0.32) | CYP2A6ASIC3LOXL2 | |
| SCHEMBL27522908 | 0.72 | — | — | |
| SCHEMBL1468406 | 0.72 | KDM4E (0.34) | CYP2A6ASIC3LOXL2MEN1ALDH1A1 | |
| SCHEMBL25363957 | 0.72 | KAT2B (0.33) | — | |
| SCHEMBL1169964 | 0.72 | — | — | |
| SCHEMBL8100154 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL27580971 | 0.71 | ALDH1A1 (0.36) | MEN1ALDH1A1MAPTHPGDKMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-1140918-B1 | THROMBIN INHIBITORS | LG LIFE SCIENCES LTD (KR) | 2004-08-11 | — | — | EP | disclosed |