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PubMed code 20462271

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50316814
PNG
(CHEMBL1097104 | cryptosphaerolide)
Show SMILES CCC(C)CC(C)CC(O)(CO)C(=O)O[C@@H]1CC[C@H](C)[C@@]2(C)C[C@H]3C(=C)CO[C@@]3(O)[C@H]3O[C@@]123 |r|
Show InChI InChI=1S/C26H42O7/c1-7-15(2)10-16(3)11-24(29,14-27)22(28)32-20-9-8-18(5)23(6)12-19-17(4)13-31-26(19,30)21-25(20,23)33-21/h15-16,18-21,27,29-30H,4,7-14H2,1-3,5-6H3/t15?,16?,18-,19-,20+,21-,23+,24?,25+,26+/m0/s1
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.14E+4n/an/an/an/an/an/a



University of California-San Diego

Curated by ChEMBL


Assay Description
Inhibition of Mcl1 protein by Mcl1/Bak fluorescence resonance assay


J Nat Prod 73: 998-1001 (2010)


Article DOI: 10.1021/np1000889
BindingDB Entry DOI: 10.7270/Q2RR1ZCX
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50316815
PNG
((1R,3S,4R,8S,10R,11S,14R)-4-methoxy-10,11-dimethyl...)
Show SMILES CCC(C)CC(C)CC(O)(CO)C(=O)O[C@@H]1CC[C@H](C)[C@@]2(C)C[C@H]3C(=C)CO[C@@]3(OC)[C@H]3O[C@@]123 |r|
Show InChI InChI=1S/C27H44O7/c1-8-16(2)11-17(3)12-25(30,15-28)23(29)33-21-10-9-19(5)24(6)13-20-18(4)14-32-27(20,31-7)22-26(21,24)34-22/h16-17,19-22,28,30H,4,8-15H2,1-3,5-7H3/t16?,17?,19-,20-,21+,22-,24+,25?,26+,27+/m0/s1
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
n/an/a 1.25E+4n/an/an/an/an/an/a



University of California-San Diego

Curated by ChEMBL


Assay Description
Inhibition of Mcl1 protein by Mcl1/Bak fluorescence resonance assay


J Nat Prod 73: 998-1001 (2010)


Article DOI: 10.1021/np1000889
BindingDB Entry DOI: 10.7270/Q2RR1ZCX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%