Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.56 |
| ▸ | NAMPT | P43490 | 10/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 1/20 | 0.45 |
| ▸ | TSHR | P16473 | 1/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL7869034 | 0.92 | ALDH1A1 (0.54) | ALDH1A1CYP19A1NAMPT | |
| SCHEMBL7868103 | 0.87 | ADRA2A (0.45) | — | |
| SCHEMBL7869019 | 0.85 | ADRA2A (0.44) | ALDH1A1NAMPTGAA | |
| SCHEMBL7869770 | 0.85 | ADRA2A (0.46) | SMN1; SMN2TSHR | |
| SCHEMBL8524130 | 0.84 | TSHR (0.55) | ALDH1A1NAMPTSMN1; SMN2TSHR | |
| Hydrochloric Acid SCHEMBL7869769 | 0.84 | TSHR (0.54) | ALDH1A1NAMPTSMN1; SMN2TSHR | |
| SCHEMBL7866501 | 0.83 | KCNH2 (0.45) | ALDH1A1NAMPTSMN1; SMN2 | |
| SCHEMBL8491686 | 0.83 | ADRA2A (0.46) | — | |
| SCHEMBL7873013 | 0.82 | PRMT5 (0.47) | ALDH1A1NAMPTSMN1; SMN2 | |
| Hydrochloric Acid SCHEMBL7869803 | 0.82 | ADRA2A (0.43) | ALDH1A1NAMPTSMN1; SMN2GAATSHR |
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-6306860-B1 | ANTIVIRAL ACTIVITIES AGAINST HEPATATIS B AS WELL AS HUMAN IMMUNODEFICIENCY VIRUS | DONG WHA PHARM. INC. CO., LTD. (KR) | 2001-10-23 | — | — | US | disclosed |
| WO-1999058526-A1 | NOVEL 2,5-PYRIDINEDICARBOXYLIC ACID DERIVATIVES | DONG WHA PHARM. IND. CO., LTD. (KR) | 1999-11-18 | — | — | WO | disclosed |