BindingDB PrimarySearch

BDBM22985 Aralen::CHEMBL76::CHLOROQUINE PHOSPHATE::Chlorochin::Chloroquine::Chloroquine, 17::med.21724, Compound 8::{4-[(7-chloroquinolin-4-yl)amino]pentyl}diethylamine

SMILES: CCN(CC)CCC[C@@H](C)Nc1ccnc2c1ccc(c2)Cl

InChI Key: InChIKey=WHTVZRBIWZFKQO-UHFFFAOYSA-N

Data: 12 KI 53 IC50 2 Kd 12 EC50

PDB links: 5 PDB IDs match this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 79 hits for monomerid = 22985
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Dihydrofolate reductase (Bovine)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	31	n/a	n/a	n/a	n/a	n/a	n/a
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Phosphoethanolamine N-methyltransferase (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	5.54E+5	n/a	n/a	n/a	n/a	n/a	n/a
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MO15-related protein kinase Pfmrk (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Major prion protein (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	4.00E+3	n/a	n/a	n/a	n/a
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Riboflavin-binding protein (Chicken)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	2.10E+3	n/a	n/a	n/a	7.4	n/a
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Ribosyldihydronicotinamide dehydrogenase [quinone] (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 3A4 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	3.50E+5	n/a	n/a	n/a	n/a	n/a	n/a
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TBA				More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Histone-lysine N-methyltransferase, H3 lysine-36 specific (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a
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TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	7.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
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C-X-C chemokine receptor type 4 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a
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TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	7.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase mTOR (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
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Angiotensin-converting enzyme 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.13E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Serine/threonine-protein kinase mTOR (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a
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Nuclear receptor subfamily 4 group A member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	4.70E+4	n/a	n/a	n/a	n/a
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Spike glycoprotein (2019-nCoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
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Dihydrofolate reductase (Bovine)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	31.3	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.69E+9	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Dihydrofolate reductase (Bovine)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	31.3	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.52E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.51E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.54E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.56E+9	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	5.90E+6	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	2.52E+5	n/a	n/a	n/a	n/a	n/a	n/a
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Integrase (Human immunodeficiency virus type 1)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	0.25	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	9.10E+8	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	4.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	6.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	76.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	3.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Histidine-rich protein PFHRP-II (malaria parasite P. falciparum)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	7.65E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Orf1a protein (MERS-CoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	6.27E+3	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Dihydrofolate reductase (Bovine)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
ATP-binding cassette sub-family C member 4 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.04E+5	n/a	n/a	n/a	n/a	n/a	n/a
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ATP-binding cassette sub-family C member 2 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
ATP-binding cassette sub-family C member 3 (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Bile salt export pump (Human)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	>1.33E+5	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	7.35E+3	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (2019-nCoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	7.28E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Replicase polyprotein 1ab (SARS-CoV)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	n/a	n/a	6.53E+3	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair
Dihydrofolate reductase (Bovine)	BDBM22985 (Aralen \| Chlorochin \| CHLOROQUINE PHOSPHATE \| Chlo...) Show SMILES Show InChI	GoogleScholar	UniChem	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA								Citation and Details
TBA				More data for this Ligand-Target Pair

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