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BDBM50332295 CHEMBL4176735

SMILES: CC(=O)Nc1cccc(c1)-c1cccc(CN)c1

InChI Key: InChIKey=OUZZCULXRLIMGP-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 = 50332295   
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))
BDBM50332295
PNG
(CHEMBL4176735)
Show SMILES CC(=O)Nc1cccc(c1)-c1cccc(CN)c1
Show InChI InChI=1S/C15H16N2O/c1-11(18)17-15-7-3-6-14(9-15)13-5-2-4-12(8-13)10-16/h2-9H,10,16H2,1H3,(H,17,18)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 6.90E+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))
BDBM50332295
PNG
(CHEMBL4176735)
Show SMILES CC(=O)Nc1cccc(c1)-c1cccc(CN)c1
Show InChI InChI=1S/C15H16N2O/c1-11(18)17-15-7-3-6-14(9-15)13-5-2-4-12(8-13)10-16/h2-9H,10,16H2,1H3,(H,17,18)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/a 6.80E+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