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BDBM50033741 (R)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-enyl acetate::1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2-yl)-4-methylpent-3-enyl acetate::Acetic acid (R)-1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydro-naphthalen-2-yl)-4-methyl-pent-3-enyl ester::Acetic acid 1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydro-naphthalen-2-yl)-4-methyl-pent-3-enyl ester::CHEMBL403516::acetylshikonin
SMILES: [#6]\[#6](-[#6])=[#6]\[#6]=[#6](-[#8]-[#6](-[#6])=O)-c1cc(-[#8])c2c(-[#8])ccc(-[#8])c2c1-[#8]
InChI Key: InChIKey=LRLDMDMGLLXGLN-UHFFFAOYSA-N
Data: 8 IC50
| Target/Host (Institution) | Ligand | Target/Host Links | Ligand Links | Trg + Lig Links | Ki nM | ΔG° kcal/mole | IC50 nM | Kd nM | EC50 nM | koff s-1 | kon M-1s-1 | pH | Temp °C |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| DNA topoisomerase 1 (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 4.50E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (2019-nCoV) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 2.43E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (2019-nCoV) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 3.80E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Sterol O-acyltransferase 2 (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 1.12E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Sterol O-acyltransferase 1 (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 1.29E+5 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Replicase polyprotein 1ab (2019-nCoV) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 350 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| COP9 signalosome complex subunit 5 (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| COP9 signalosome complex subunit 5 (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 1.07E+3 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Neuraminidase (Influenza A virus (strain A/Brevig Mission/1/1918 ...) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 4.14E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||
| Telomerase reverse transcriptase (Human) | BDBM50033741![]() (1-(5,8-dihydroxy-1,4-dioxo-1,4-dihydronaphthalen-2...) | GoogleScholar | UniChem | n/a | n/a | 3.73E+4 | n/a | n/a | n/a | n/a | n/a | n/a | |
TBA | Citation and Details | ||||||||||||
| More data for this Ligand-Target Pair | |||||||||||||