BindingDB logo
myBDB logout

BDBM50207643 (1S,3R)-N-(2-(cyclopentanecarboxamido)benzo[d]thiazol-6-yl)-3-(naphthalen-2-ylmethylamino)cyclohexanecarboxamide::CHEMBL253804

SMILES: O=C(Nc1nc2ccc(NC(=O)[C@H]3CCC[C@H](C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCC1

InChI Key: InChIKey=DJBPAGGSUSAEKT-LOSJGSFVSA-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 = 50207643   
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))
BDBM50207643
PNG
((1S,3R)-N-(2-(cyclopentanecarboxamido)benzo[d]thia...)
Show SMILES O=C(Nc1nc2ccc(NC(=O)[C@H]3CCC[C@H](C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCC1
Show InChI InChI=1S/C31H34N4O2S/c36-29(22-7-2-3-8-22)35-31-34-27-15-14-26(18-28(27)38-31)33-30(37)24-10-5-11-25(17-24)32-19-20-12-13-21-6-1-4-9-23(21)16-20/h1,4,6,9,12-16,18,22,24-25,32H,2-3,5,7-8,10-11,17,19H2,(H,33,37)(H,34,35,36)/t24-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 0.490n/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))
BDBM50207643
PNG
((1S,3R)-N-(2-(cyclopentanecarboxamido)benzo[d]thia...)
Show SMILES O=C(Nc1nc2ccc(NC(=O)[C@H]3CCC[C@H](C3)NCc3ccc4ccccc4c3)cc2s1)C1CCCC1
Show InChI InChI=1S/C31H34N4O2S/c36-29(22-7-2-3-8-22)35-31-34-27-15-14-26(18-28(27)38-31)33-30(37)24-10-5-11-25(17-24)32-19-20-12-13-21-6-1-4-9-23(21)16-20/h1,4,6,9,12-16,18,22,24-25,32H,2-3,5,7-8,10-11,17,19H2,(H,33,37)(H,34,35,36)/t24-,25+/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 0.490n/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