BDBM85509 CAS_55142-85-3::NSC_5472::Ticlopidine

SMILES: c1ccc(c(c1)C[N@]2CCc3c(ccs3)C2)Cl

InChI Key: InChIKey=PHWBOXQYWZNQIN-UHFFFAOYSA-N

Data: 6 KI  17 IC50

PDB links: 1 PDB ID matches 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 23 hits for monomerid = 85509   

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 2C19 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 3A4 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.27E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C9 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	3.11E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C19 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.84E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Rat)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 1A2 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	8.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2D6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2J2 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2B6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	210	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) 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
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ATP-binding cassette sub-family C member 4 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) 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
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ATP-binding cassette sub-family C member 3 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) 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
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ATP-binding cassette sub-family C member 2 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) 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
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Cytochrome P450 2B6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	7.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Bile salt export pump (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2B6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	600	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2B6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		200	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2B6 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		800	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C19 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 1 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Prostaglandin G/H synthase 2 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Cytochrome P450 2C19 (Human)	BDBM85509 (NSC_5472 | CAS_55142-85-3 | Ticlopidine) Show SMILES Show InChI	GoogleScholar	UniChem		8.70E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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