BDBM12592 3-({4-[(6-CHLORO-1-BENZOTHIEN-2-YL)SULFONYL]-2-OXOPIPERAZIN-1-YL}METHYL)BENZENECARBOXIMIDAMIDE::3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-oxopiperazin-1-yl}methyl)benzene-1-carboximidamide::Ketopiperazine::RPR132747

SMILES: c1cc(cc(c1)C(=N)N)CN2CC[N@@](CC2=O)S(=O)(=O)c3cc4ccc(cc4s3)Cl

InChI Key: InChIKey=PRMSFVUWLBPPLY-UHFFFAOYSA-N

Data: 5 KI

PDB links: 1 PDB ID matches this monomer.

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 12592   

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
Coagulation factor X (Human)	BDBM12592 (3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-o...) Show SMILES Show InChI	GoogleScholar	UniChem		4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Coagulation factor X (Human)	BDBM12592 (3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-o...) Show SMILES Show InChI	GoogleScholar	UniChem		18	-10.5	n/a	n/a	n/a	n/a	n/a	7.5	22
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Serine protease 1 (Bovine)	BDBM12592 (3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-o...) Show SMILES Show InChI	GoogleScholar	UniChem		>2.90E+3	>-7.47	n/a	n/a	n/a	n/a	n/a	7.5	22
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Prothrombin (Human)	BDBM12592 (3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-o...) Show SMILES Show InChI	GoogleScholar	UniChem		>4.00E+3	>-7.28	n/a	n/a	n/a	n/a	n/a	7.5	22
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Prothrombin (Human)	BDBM12592 (3-({4-[(6-chloro-1-benzothiophene-2-)sulfonyl]-2-o...) Show SMILES Show InChI	GoogleScholar	UniChem		>4.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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