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BDBM50207627 3-[(naphthalen-2-ylmethyl)-amino]-cyclohexanecarboxylic acid [2-(cyclohexanecarbonyl-amino)-benzothiazol-6-yl]-amide::CHEMBL401095

SMILES: O=C(Nc1nc2ccc(NC(=O)C3CCCC(C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCCC1

InChI Key: InChIKey=VZSYTNVKRSAXSQ-UHFFFAOYSA-N

Data: 2 IC50

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 = 50207627   
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
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50207627
PNG
(3-[(naphthalen-2-ylmethyl)-amino]-cyclohexanecarbo...)
Show SMILES O=C(Nc1nc2ccc(NC(=O)C3CCCC(C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCCC1 |w:16.18,12.11|
Show InChI InChI=1S/C32H36N4O2S/c37-30(23-8-2-1-3-9-23)36-32-35-28-16-15-27(19-29(28)39-32)34-31(38)25-11-6-12-26(18-25)33-20-21-13-14-22-7-4-5-10-24(22)17-21/h4-5,7,10,13-17,19,23,25-26,33H,1-3,6,8-9,11-12,18,20H2,(H,34,38)(H,35,36,37)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.10n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of Candida albicans N-myristoyltransferse


Eur J Med Chem 42: 477-86 (2007)


Article DOI: 10.1016/j.ejmech.2006.11.001
BindingDB Entry DOI: 10.7270/Q2RV0ND9
More data for this
Ligand-Target Pair
Myristoyl-CoA:protein N-myristoyltransferase (Nmt)


(Candida albicans (Yeast))
BDBM50207627
PNG
(3-[(naphthalen-2-ylmethyl)-amino]-cyclohexanecarbo...)
Show SMILES O=C(Nc1nc2ccc(NC(=O)C3CCCC(C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCCC1 |w:16.18,12.11|
Show InChI InChI=1S/C32H36N4O2S/c37-30(23-8-2-1-3-9-23)36-32-35-28-16-15-27(19-29(28)39-32)34-31(38)25-11-6-12-26(18-25)33-20-21-13-14-22-7-4-5-10-24(22)17-21/h4-5,7,10,13-17,19,23,25-26,33H,1-3,6,8-9,11-12,18,20H2,(H,34,38)(H,35,36,37)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 8.10n/an/an/an/an/an/a



Second Military Medical University

Curated by ChEMBL


Assay Description
Inhibition of Candida albicans N-myristoyltransferse


Eur J Med Chem 42: 477-86 (2007)


Article DOI: 10.1016/j.ejmech.2006.11.001
BindingDB Entry DOI: 10.7270/Q2RV0ND9
More data for this
Ligand-Target Pair