Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTR | P02766 | 1/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 2/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | SLC22A2 | O15244 | 1/20 | 0.34 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.34 |
| ▸ | SLC22A3 | O75751 | 1/20 | 0.34 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.34 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.34 |
| ▸ | TYMP | P19971 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.33 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | AR | P10275 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL22928191 | 0.83 | TTR (0.37) | TTRLMNANFE2L2ACHECASP3 | |
| SCHEMBL5390122 | 0.83 | TTR (0.58) | TTRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL18920518 | 0.81 | NPC1 (0.50) | TTRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| Hydrochloric Acid SCHEMBL30833257 | 0.80 | TTR (0.56) | TTRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL1768313 | 0.77 | KCNN4 (0.41) | TTRNFE2L2ACHECASP3SENP8 | |
| SCHEMBL4612869 | 0.74 | ALDH1A1 (0.41) | HTTLMNAMAPTALDH1A1ESR1 | |
| SCHEMBL5066123 | 0.74 | TTR (0.45) | TTRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL3620806 | 0.73 | TTR (0.48) | TTRCYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL18939793 | 0.73 | TTR (0.35) | TTRLMNACASP3SENP8SENP7 | |
| SCHEMBL30476137 | 0.73 | CYP2A6 (0.44) | CYP1A2HTTLMNAMAPTALDH1A1 |
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-20180083317-A1 | ADDITIVE COMPOSITION FOR LITHIUM BATTERY ELECTROLYTE, ORGANIC ELECTROLYTE INCLUDING THE SAME, AND LITHIUM BATTERY INCLUDING THE ADDITIVE COMPOSITION | SAMSUNG SDI CO., LTD. (KR) | 2018-03-22 | — | — | US | disclosed |