Identical Ligands in BindingDB

Found 1 hit Enzyme Inhibition Constant Data   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Prothrombin   (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8) Show SMILES CC(=O)N[C@H](CC1CCCCC1)C(=O)N1CCCC1C(=O)NCc1cccc(Cl)c1 |r| Show InChI InChI=1S/C23H32ClN3O3/c1-16(28)26-20(14-17-7-3-2-4-8-17)23(30)27-12-6-11-21(27)22(29)25-15-18-9-5-10-19(24)13-18/h5,9-10,13,17,20-21H,2-4,6-8,11-12,14-15H2,1H3,(H,25,29)(H,26,28)/t20-,21?/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid PDB UniChem Similars	PDB Article PubMed	8.70E+3	-28.9	n/a	n/a	n/a	n/a	n/a	7.4	25
Philipps-University Marburg					Assay Description Kinetic inhibition of human thrombin was determined photometrically at 405 nm using the chromogenic substrate Pefachrom tPa. Reactions were performed...				J Mol Biol 391: 552-64 (2009) Article DOI: 10.1016/j.jmb.2009.06.016 BindingDB Entry DOI: 10.7270/Q2RV0M1Z
					More data for this Ligand-Target Pair				3D Structure (crystal)

Identical Ligands in BindingDB

Found 3 hits Isothermal Titration Calorimetry Data

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kJ/mole	-TΔS° kJ/mole	ΔH° kJ/mole	log K	pH	Temp °C
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-33.1	-15.6	-17.4	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-32.8	-18.5	-14.3	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-32.6	-3.61	-29	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)

Similar Ligands in BindingDB^*

Found 3 hits Isothermal Titration Calorimetry Data

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kJ/mole	-TΔS° kJ/mole	ΔH° kJ/mole	log K	pH	Temp °C
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-33.1	-15.6	-17.4	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-32.8	-18.5	-14.3	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)
Thrombin  (259/259 = 100%)† (Homo sapiens (Human))	BDBM32659 (m-chlorobenzylamide, 8)	GoogleScholar PDB	PC cid PC sid PDB		-32.6	-3.61	-29	n/a	7.80	25
Philipps-University Marburg					J Mol Biol 391: 552-64 (2009)

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