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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Deoxyribonuclease-2-alpha' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
pHTemp
°C
Deoxyribonuclease-2-alpha


(Homo sapiens)
BDBM50326048
PNG
((2R,5S,8S,11S,14S,17S,20S,23S,26S,29S,32S,35R)-8,1...)
Show SMILES CC(C)C[C@H](NC(=O)[C@@H](N)CS)C(=O)N[C@@H](CCCN=C(N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N[C@@H](C)C(=O)N[C@@H](CS)C(O)=O
Show InChI InChI=1S/C75H110N18O14S2/c1-39(2)28-54(86-64(96)49(76)37-108)68(100)84-52(24-17-27-80-75(78)79)65(97)87-56(30-41(5)6)70(102)88-55(29-40(3)4)69(101)85-53(25-26-62(77)94)66(98)91-60(34-46-36-82-51-23-16-14-21-48(46)51)73(105)90-58(32-44-18-11-10-12-19-44)72(104)89-57(31-42(7)8)71(103)92-59(33-45-35-81-50-22-15-13-20-47(45)50)67(99)83-43(9)63(95)93-61(38-109)74(106)107/h10-16,18-23,35-36,39-43,49,52-61,81-82,108-109H,17,24-34,37-38,76H2,1-9H3,(H2,77,94)(H,83,99)(H,84,100)(H,85,101)(H,86,96)(H,87,97)(H,88,102)(H,89,104)(H,90,105)(H,91,98)(H,92,103)(H,93,95)(H,106,107)(H4,78,79,80)/t43-,49-,52-,53-,54-,55-,56-,57-,58-,59-,60-,61-/m0/s1
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PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
200n/an/an/an/an/an/an/an/a



Laboratory of Molecular Biology, Medical Research Council

Curated by ChEMBL


Assay Description
Binding affinity to Dnase 2


Citation and Details
More data for this
Ligand-Target Pair