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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Complement factor D' and Ligand = 'BDBM50332017'   
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 factor D


(Homo sapiens (Human))
BDBM50332017
PNG
(CHEMBL4165382)
Show SMILES NC(=O)c1cc2c(NC(=O)C34CC5CC(CC(N)(C5)C3)C4)cccc2[nH]1 |TLB:20:10:18:13.14.15,8:10:18:13.14.15,17:16:11:13.20.14,THB:20:14:11.10.19:18,15:14:11:19.16.18,15:16:11:13.20.14|
Show InChI InChI=1S/C20H24N4O2/c21-17(25)16-5-13-14(23-16)2-1-3-15(13)24-18(26)19-6-11-4-12(7-19)9-20(22,8-11)10-19/h1-3,5,11-12,23H,4,6-10,22H2,(H2,21,25)(H,24,26)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
PDB
UniChem

Similars

PDB
Article
PubMed
n/an/an/a>2.00E+6n/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Binding affinity to 15-N labeled complement factor D (unknown origin) by 1H-15N HSQC NMR analysis


ACS Med Chem Lett 9: 490-495 (2018)


Article DOI: 10.1021/acsmedchemlett.8b00104
BindingDB Entry DOI: 10.7270/Q2K35X6P
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)