Reaction Details Report a problem with these data
Target
Coagulation factor X
Ligand
BDBM19038
Substrate
BDBM12500
Meas. Tech.
Enzyme Assay and Determination of the Inhibition Constants.
pH
7.0000±n/a
Temperature
295.1500±n/a K
Ki
0.26±n/a nM
Citation
 Qiao, JX; Cheng, X; Smallheer, JM; Galemmo, RA; Drummond, S; Pinto, DJ; Cheney, DL; He, K; Wong, PC; Luettgen, JM; Knabb, RM; Wexler, RR; Lam, PY Pyrazole-based factor Xa inhibitors containing N-arylpiperidinyl P4 residues. Bioorg Med Chem Lett 17:1432-7 (2007) [PubMed]  Article 
Target
Name:
Coagulation factor X
Synonyms:
Activated coagulation factor X (FXa) | Activated factor Xa heavy chain | Coagulation factor X precursor | Coagulation factor Xa | Factor X heavy chain | Factor X light chain | Factor Xa | Stuart factor | Stuart-Prower factor | FA10_HUMAN | F10
Type:
Enzyme
Mol. Mass.:
54726.60
Organism:
Human
Description:
n/a
Residue:
488
Sequence:
MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK
  
Inhibitor
Name:
BDBM19038
Synonyms:
1-(4-methoxyphenyl)-7-oxo-6-{1-[2-(pyrrolidin-1-ylmethyl)phenyl]piperidin-4-yl}-1H,4H,5H,6H,7H-pyrazolo[3,4-c]pyridine-3-carboxamide | Pyrazole-based inhibitor containing N-arylpiperidiny, 16c
Type:
Small organic molecule
Emp. Form.:
C30H36N6O3
Mol. Mass.:
528.28
SMILES:
COc1ccc(cc1)-n1nc(C(N)=O)c2CCN(C3CCN(CC3)c3ccccc3CN3CCCC3)C(=O)c12
Structure:
Search PDB for entries with ligand similarity:
Substrate
Name:
BDBM12500
Synonyms:
N-alpha-Z-D-Arg-Gly-Arg-p-nitroanilide | N-a-Benzyloxycarbonyl-Darginyl-L-glycyl-L-arginine-pnitroaniline | Cbz-D-Arg-Gly-L-Arg-pNA | benzyl N-[(1R)-4-carbamimidamido-1-[({[(1S)-4-carbamimidamido-1-[(4-nitrophenyl)carbamoyl]butyl]carbamoyl}methyl)carbamoyl]butyl]carbamate | Chromogenic Substrate S-2765
Type:
Small organic molecule
Emp. Form.:
C28H11N11O7
Mol. Mass.:
613.08
SMILES:
[#7]\[#6](-[#7])=[#7]/[#6]-[#6]-[#6]-[#6@@H](-[#7]-[#6](=O)-[#8]-[#6]-c1ccccc1)-[#6](=O)-[#7]-[#6]-[#6](=O)-[#7]-[#6@@H](-[#6]-[#6]-[#6]-[#7+]=[#6](-[#7])-[#7-])-[#6](=O)-[#7]-c1ccc(cc1)-[#7+](-[#8-])=O |r,w:30.30|
Structure:
Search PDB for entries with ligand similarity: