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BDBM50330953 CHEMBL4159632

SMILES: NCc1cccc(c1)-c1cccc(NC(=O)c2ccccc2)c1

InChI Key: InChIKey=WGIKZSZDLXUEEA-UHFFFAOYSA-N

Data: 1 IC50  1 Kd

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50330953   
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
Complement factor D


(Homo sapiens (Human))
BDBM50330953
PNG
(CHEMBL4159632)
Show SMILES NCc1cccc(c1)-c1cccc(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O/c21-14-15-6-4-9-17(12-15)18-10-5-11-19(13-18)22-20(23)16-7-2-1-3-8-16/h1-13H,14,21H2,(H,22,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.57E+5n/an/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Displacement of 19F[(S)-methyl 2-((2-(3-(trifluoromethoxy)phenylcarbamoyl)pyrrolidine-1-carboxamido)methyl)benzoate] from complement factor D (unknow...


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
Complement factor D


(Homo sapiens (Human))
BDBM50330953
PNG
(CHEMBL4159632)
Show SMILES NCc1cccc(c1)-c1cccc(NC(=O)c2ccccc2)c1
Show InChI InChI=1S/C20H18N2O/c21-14-15-6-4-9-17(12-15)18-10-5-11-19(13-18)22-20(23)16-7-2-1-3-8-16/h1-13H,14,21H2,(H,22,23)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.20E+5n/an/an/an/an/a



Novartis Pharma AG

Curated by ChEMBL


Assay Description
Displacement of 19F[(S)-methyl 2-((2-(3-(trifluoromethoxy)phenylcarbamoyl)pyrrolidine-1-carboxamido)methyl)benzoate] from complement factor D (unknow...


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