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BDBM50542146 CHEMBL4638180

SMILES: ONC(=O)C[C@@H](CC1CCCC1)C(=O)N1CC2(CC2)C[C@H]1C(=O)Nc1ccncn1

InChI Key: InChIKey=BSGPNGMUYSQBBL-CVEARBPZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50542146   
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
Peptide deformylase mitochondrial


(Homo sapiens (Human))		BDBM50542146
PNG
(CHEMBL4638180)
Show SMILES ONC(=O)C[C@@H](CC1CCCC1)C(=O)N1CC2(CC2)C[C@H]1C(=O)Nc1ccncn1 |r|
Show InChI InChI=1S/C21H29N5O4/c27-18(25-30)10-15(9-14-3-1-2-4-14)20(29)26-12-21(6-7-21)11-16(26)19(28)24-17-5-8-22-13-23-17/h5,8,13-16,30H,1-4,6-7,9-12H2,(H,25,27)(H,22,23,24,28)/t15-,16+/m1/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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DrugBank
antibodypedia
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PC cid
PC sid
UniChem
PubMed
n/an/a 9.5n/an/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Inhibition of human PDF expressed in Escherichia coli BL21 pLysS using formyl-Met-Ala-His-Ala peptide as substrate measured after 1 hr by fluorescami...

J Med Chem 63: 6959-6978 (2020)

More data for this
Ligand-Target Pair