BDBM8610 1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one::24F2-1,25(OH)D3::CHEMBL75::KTZ::Ketoconazole::Ketoconazole (k)::US9138393, Ketoconozole::US9144538, Ketoconozole

SMILES: CC(=O)N1CCN(CC1)c2ccc(cc2)OC[C@H]3CO[C@](O3)(Cn4ccnc4)c5ccc(cc5Cl)Cl

InChI Key: InChIKey=XMAYWYJOQHXEEK-UHFFFAOYSA-N

Data: 9 KI  117 IC50  7 Kd

PDB links: 4 PDB IDs match this monomer.

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 134 hits for monomerid = 8610   

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
Cytochrome P450 11B1, mitochondrial (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	224	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	224	n/a	n/a	n/a	n/a	7.4	37
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					More data for this Ligand-Target Pair
Aromatase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.78E+3	n/a	n/a	n/a	n/a	7.4	37
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					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	67	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	72	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 11B1, mitochondrial (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	127	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Sterol 14-alpha demethylase (Trypanosoma cruzi (strain CL Brener))	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	20	n/a	n/a	n/a	6.0	n/a
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					More data for this Ligand-Target Pair
Lanosterol 14-alpha-demethylase (Trypanosoma brucei brucei (strain 927/4 GUTat10.1))	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	6.0	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 144 (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	1.34E+5	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Steroid C26-monooxygenase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.71E+4	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Steroid C26-monooxygenase (Mycobacterium tuberculosis (strain CDC 1551 / Oshk...)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	7.4	4
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	500	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aromatase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	146	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	48	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aromatase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	65	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) 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
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Aromatase (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	951	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	17	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 3A5 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	513	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A5 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	141	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A5 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	162	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	117	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A5 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	439	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A5 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	3.10E+3	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	900	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	60	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	37	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	38	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	140	n/a	n/a	n/a	n/a	n/a	n/a
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Heme oxygenase 1 (Rat)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
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Heme oxygenase 2 (Rat)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) 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
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Human)	BDBM8610 (24F2-1,25(OH)D3 | Ketoconazole (k) | KTZ | 1-[4-(4...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair