Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetProthrombin
LigandBDBM50112079
Substrate/Competitorn/a
Meas. Tech.ChEMBL_225421 (CHEMBL845034)
IC50 130±n/a nM
Citation Hauel, NHNar, HPriepke, HRies, UStassen, JMWienen, W Structure-based design of novel potent nonpeptide thrombin inhibitors. J Med Chem45:1757-66 (2002) [PubMed]
More Info.:Get all data from this article,  Assay Method
 
Prothrombin
Name:Prothrombin
Synonyms:Activation peptide fragment 1 | Activation peptide fragment 2 | Coagulation factor II | F2 | Prothrombin precursor | THRB_HUMAN | Thrombin heavy chain | Thrombin light chain
Type:Protein
Mol. Mass.:70029.57
Organism:Homo sapiens (Human)
Description:P00734
Residue:622
Sequence:
MAHVRGLQLPGCLALAALCSLVHSQHVFLAPQQARSLLQRVRRANTFLEEVRKGNLEREC
VEETCSYEEAFEALESSTATDVFWAKYTACETARTPRDKLAACLEGNCAEGLGTNYRGHV
NITRSGIECQLWRSRYPHKPEINSTTHPGADLQENFCRNPDSSTTGPWCYTTDPTVRRQE
CSIPVCGQDQVTVAMTPRSEGSSVNLSPPLEQCVPDRGQQYQGRLAVTTHGLPCLAWASA
QAKALSKHQDFNSAVQLVENFCRNPDGDEEGVWCYVAGKPGDFGYCDLNYCEEAVEEETG
DGLDEDSDRAIEGRTATSEYQTFFNPRTFGSGEADCGLRPLFEKKSLEDKTERELLESYI
DGRIVEGSDAEIGMSPWQVMLFRKSPQELLCGASLISDRWVLTAAHCLLYPPWDKNFTEN
DLLVRIGKHSRTRYERNIEKISMLEKIYIHPRYNWRENLDRDIALMKLKKPVAFSDYIHP
VCLPDRETAASLLQAGYKGRVTGWGNLKETWTANVGKGQPSVLQVVNLPIVERPVCKDST
RIRITDNMFCAGYKPDEGKRGDACEGDSGGPFVMKSPFNNRWYQMGIVSWGEGCDRDGKY
GFYTHVFRLKKWIQKVIDQFGE
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50112079
n/a
NameBDBM50112079
Synonyms:4-[[2-(4-Carbamimidoyl-benzyl)-1-methyl-1H-benzoimidazol-5-yl]-(quinoline-8-sulfonyl)-amino]-butyric acid | CHEMBL299580
TypeSmall organic molecule
Emp. Form.C29H28N6O4S
Mol. Mass.556.635
SMILESCn1c(Cc2ccc(cc2)C(N)=N)nc2cc(ccc12)N(CCCC(O)=O)S(=O)(=O)c1cccc2cccnc12
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: