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BDBM50324783 (3R,4R)-N3-(4-chlorophenyl)-N4-(4-(2,5-dihydro-1H-pyrrole-1-carbonyl)phenyl)-1-(methylsulfonyl)pyrrolidine-3,4-dicarboxamide::CHEMBL1222225

SMILES: CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)C(=O)N1CC=CC1)C(=O)Nc1ccc(Cl)cc1

InChI Key: InChIKey=UDWQYEIEVDKVQR-SFTDATJTSA-N

Data: 1 KI

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50324783   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50324783
PNG
((3R,4R)-N3-(4-chlorophenyl)-N4-(4-(2,5-dihydro-1H-...)
Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)C(=O)N1CC=CC1)C(=O)Nc1ccc(Cl)cc1 |r,c:24|
Show InChI InChI=1S/C24H25ClN4O5S/c1-35(33,34)29-14-20(21(15-29)23(31)27-19-10-6-17(25)7-11-19)22(30)26-18-8-4-16(5-9-18)24(32)28-12-2-3-13-28/h2-11,20-21H,12-15H2,1H3,(H,26,30)(H,27,31)/t20-,21-/m0/s1
PDB
MMDB

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PC cid
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Article
PubMed
92n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Binding affinity to factor 10a


Bioorg Med Chem Lett 20: 5313-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.126
BindingDB Entry DOI: 10.7270/Q2542NSG
More data for this
Ligand-Target Pair