Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAMPT | P43490 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HTR1A | P08908 | 1/20 | 0.31 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.31 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.31 |
| ▸ | MAOA | P21397 | 1/20 | 0.31 |
| ▸ | HTR2B | P41595 | 1/20 | 0.31 |
| ▸ | NPC1 | O15118 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | SSTR4 | P31391 | 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 | |
|---|---|---|---|---|
| SCHEMBL7717027 | 0.81 | TSHR (0.38) | TSHRALDH1A1NPC1RAB9A | |
| SCHEMBL1761160 | 0.78 | DYRK1A (0.38) | NAMPTTSHRALDH1A1HTR1AADRA2A | |
| SCHEMBL4424952 | 0.75 | AR (0.41) | NAMPTTSHRALDH1A1NPC1RAB9A | |
| SCHEMBL31667703 | 0.72 | TSHR (0.43) | TSHRALDH1A1 | |
| SCHEMBL6354890 | 0.72 | TSHR (0.43) | TSHRALDH1A1 | |
| SCHEMBL29513232 | 0.70 | CYP19A1 (0.46) | TSHRALDH1A1NPC1RAB9A | |
| SCHEMBL899 | 0.70 | CYP19A1 (0.46) | TSHRALDH1A1NPC1RAB9A | |
| SCHEMBL3053661 | 0.70 | TSHR (0.35) | TSHRALDH1A1NPC1RAB9A | |
| SCHEMBL1232356 | 0.70 | GABRA1 (0.37) | TSHRALDH1A1 | |
| SCHEMBL1125092 | 0.70 | SMN1; SMN2 (0.37) | TSHRALDH1A1MAOA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1254136-A4 | FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF | LG CHEM INVESTMENT LTD (KR) | 2005-06-01 | — | — | EP | disclosed |
| EP-1254136-A1 | FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF | LG Chem Investment, Ltd. (KR) | 2002-11-06 | — | — | EP | disclosed |
| WO-2001055146-A1 | FACTOR Xa INHIBITORS WITH ARYL-AMIDINES AND DERIVATIVES, AND PRODRUGS THEREOF | LG CHEM INVESTMENT LTD. (KR) | 2001-08-02 | — | — | WO | disclosed |