Reaction Details Report a problem with these data
Target
Coagulation factor X
Ligand
BDBM50222067
Substrate
n/a
Meas. Tech.
ChEMBL_457737 (CHEMBL924015)
IC50
1100±n/a nM
Citation
 Shi, Y; Sitkoff, D; Zhang, J; Han, W; Hu, Z; Stein, PD; Wang, Y; Kennedy, LJ; O'Connor, SP; Ahmad, S; Liu, EC; Seiler, SM; Lam, PY; Robl, JA; Macor, JE; Atwal, KS; Zahler, R Amino(methyl) pyrrolidines as novel scaffolds for factor Xa inhibitors. Bioorg Med Chem Lett 17:5952-8 (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 | F10 | FA10_HUMAN | Factor X heavy chain | Factor X light chain | Factor Xa | Stuart factor | Stuart-Prower factor
Type:
Enzyme
Mol. Mass.:
54726.60
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
488
Sequence:
MGRPLHLVLLSASLAGLLLLGESLFIRREQANNILARVTRANSFLEEMKKGHLERECMEETCSYEEAREVFEDSDKTNEFWNKYKDGDQCETSPCQNQGKCKDGLGEYTCTCLEGFEGKNCELFTRKLCSLDNGDCDQFCHEEQNSVVCSCARGYTLADNGKACIPTGPYPCGKQTLERRKRSVAQATSSSGEAPDSITWKPYDAADLDPTENPFDLLDFNQTQPERGDNNLTRIVGGQECKDGECPWQALLINEENEGFCGGTILSEFYILTAAHCLYQAKRFKVRVGDRNTEQEEGGEAVHEVEVVIKHNRFTKETYDFDIAVLRLKTPITFRMNVAPACLPERDWAESTLMTQKTGIVSGFGRTHEKGRQSTRLKMLEVPYVDRNSCKLSSSFIITQNMFCAGYDTKQEDACQGDSGGPHVTRFKDTYFVTGIVSWGEGCARKGKYGIYTKVTAFLKWIDRSMKTRGLPKAKSHAPEVITSSPLK
  
Inhibitor
Name:
BDBM50222067
Synonyms:
CHEMBL249629 | N-((1-(1-(pyridin-4-yl)piperidine-4-carbonyl)pyrrolidin-3-yl)methyl)naphthalene-2-sulfonamide
Type:
Small organic molecule
Emp. Form.:
C26H30N4O3S
Mol. Mass.:
478.606
SMILES:
O=C(C1CCN(CC1)c1ccncc1)N1CCC(CNS(=O)(=O)c2ccc3ccccc3c2)C1 |w:17.19|
Structure:
Search PDB for entries with ligand similarity: