BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Complement C3' and Ligand = 'BDBM50159036'   
Target/Host
(Institution)		LigandTarget/Host
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
Complement C3


(Homo sapiens (Human))		BDBM50159036
PNG
(Ac-I[CVWQDWGAHdRC]T | CHEMBL410971)
Show SMILES CC[C@H](C)[C@H](N)C(=O)N[C@H]1CSSC[C@H](NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](Cc2cnc[nH]2)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](Cc2c[nH]c3ccccc23)NC(=O)[C@@H](NC1=O)C(C)C)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
Show InChI InChI=1S/C69H98N22O17S2/c1-7-33(4)54(71)67(107)89-50-30-110-109-29-49(66(106)91-56(35(6)92)57(72)97)88-60(100)43(17-12-20-76-69(73)74)82-63(103)47(23-38-27-75-31-80-38)84-58(98)34(5)81-52(94)28-79-59(99)45(21-36-25-77-41-15-10-8-13-39(36)41)85-64(104)48(24-53(95)96)86-61(101)44(18-19-51(70)93)83-62(102)46(87-68(108)55(32(2)3)90-65(50)105)22-37-26-78-42-16-11-9-14-40(37)42/h8-11,13-16,25-27,31-35,43-50,54-56,77-78,92H,7,12,17-24,28-30,71H2,1-6H3,(H2,70,93)(H2,72,97)(H,75,80)(H,79,99)(H,81,94)(H,82,103)(H,83,102)(H,84,98)(H,85,104)(H,86,101)(H,87,108)(H,88,100)(H,89,107)(H,90,105)(H,91,106)(H,95,96)(H4,73,74,76)/t33-,34-,35+,43+,44-,45-,46+,47+,48+,49-,50-,54-,55-,56-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a>1.00E+6n/an/an/an/an/an/a



University of California at Riverside

Curated by ChEMBL


Assay Description
Inhibitory concentration for human complement component C3 activation

J Med Chem 48: 274-86 (2005)


Article DOI: 10.1021/jm0495531
BindingDB Entry DOI: 10.7270/Q2DR2W81
More data for this
Ligand-Target Pair