Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.35 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | PTGS2 | P35354 | 2/20 | 0.32 |
| ▸ | TTR | P02766 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | TP53 | P04637 | 2/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | ABL1 | P00519 | 1/20 | 0.32 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.32 |
| ▸ | BCR | P11274 | 1/20 | 0.32 |
| ▸ | NPC1 | O15118 | 1/20 | 0.32 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.32 |
| ▸ | CASP3 | P42574 | 1/20 | 0.32 |
| ▸ | RAB9A | P51151 | 1/20 | 0.32 |
| ▸ | SENP8 | Q96LD8 | 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 | |
|---|---|---|---|---|
| SCHEMBL9517612 | 0.86 | ALDH1A1 (0.39) | ALDH1A1 | |
| SCHEMBL1594100 | 0.78 | CA1 (0.42) | BACE1GABRA1GABRB2TDP1HSP90AA1 | |
| SCHEMBL8832347 | 0.77 | CYP3A4 (0.52) | GABRA1GABRB2ALDH1A1ABL1BCR | |
| SCHEMBL2461839 | 0.76 | ALDH1A1 (0.37) | ALDH1A1TDP1SMN1; SMN2MAPK1CYP3A4 | |
| SCHEMBL13318432 | 0.74 | ESR2 (0.50) | ALDH1A1NPC1RAB9ACYP3A4MAPT | |
| SCHEMBL17204006 | 0.73 | CA12 (0.32) | BACE1GABRA1GABRB2TDP1 | |
| SCHEMBL18803156 | 0.72 | — | — | |
| SCHEMBL5343627 | 0.72 | PLA2G2A (0.46) | ALDH1A1TDP1PTGS2TP53SMN1; SMN2 | |
| SCHEMBL3901324 | 0.70 | LMNA (0.38) | ALDH1A1TDP1CYP1A1CYP1B1TP53 | |
| SCHEMBL11415062 | 0.70 | ALDH1A1 (0.42) | ALDH1A1TDP1SMN1; SMN2MAPK1CYP3A4 |
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-20170162904-A1 | ADDITIVE FOR ELECTROCHEMICAL ELEMENT, ELECTROLYTE COMPRISING SAME, ELECTRODE, AND ELECTROCHEMICAL ELEMENT | LG CHEM, LTD. (KR) | 2017-06-08 | — | — | US | disclosed |
| US-20170162904-A1 | ADDITIVE FOR ELECTROCHEMICAL ELEMENT, ELECTROLYTE COMPRISING SAME, ELECTRODE, AND ELECTROCHEMICAL ELEMENT | LG CHEM, LTD. (KR) | 2017-06-08 | — | — | US | disclosed |