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BDBM92917 Aryl 1-indanylketone, 6

SMILES: COc1ccc(F)cc1C(=O)C1(C)CCc2ccccc12

InChI Key: InChIKey=VNSSZWJYFXKTLT-UHFFFAOYSA-N

Data: 2 KI

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 = 92917   
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
Cyclophilin B (CypB)


(Homo sapiens (Human))
BDBM92917
PNG
(Aryl 1-indanylketone, 6)
Show SMILES COc1ccc(F)cc1C(=O)C1(C)CCc2ccccc12
Show InChI InChI=1S/C18H17FO2/c1-18(10-9-12-5-3-4-6-15(12)18)17(20)14-11-13(19)7-8-16(14)21-2/h3-8,11H,9-10H2,1-2H3
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
>1.00E+5>-5.09n/an/an/an/an/a7.85



Max Planck Research



Assay Description
PPIase activity assay were performed at 283 K in quartz cuvettes with a path length of 1 cm under vigorous stirring with a Hewlett-Packard 8453A UV-v...


Biochemistry 48: 6268-77 (2009)


Article DOI: 10.1021/bi9007287
BindingDB Entry DOI: 10.7270/Q2X34W26
More data for this
Ligand-Target Pair
Peptidyl-prolyl cis-trans isomerase A


(Homo sapiens (Human))
BDBM92917
PNG
(Aryl 1-indanylketone, 6)
Show SMILES COc1ccc(F)cc1C(=O)C1(C)CCc2ccccc12
Show InChI InChI=1S/C18H17FO2/c1-18(10-9-12-5-3-4-6-15(12)18)17(20)14-11-13(19)7-8-16(14)21-2/h3-8,11H,9-10H2,1-2H3
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

Article
PubMed
>1.00E+5>-5.09n/an/an/an/an/a7.85



Max Planck Research



Assay Description
PPIase activity assay were performed at 283 K in quartz cuvettes with a path length of 1 cm under vigorous stirring with a Hewlett-Packard 8453A UV-v...


Biochemistry 48: 6268-77 (2009)


Article DOI: 10.1021/bi9007287
BindingDB Entry DOI: 10.7270/Q2X34W26
More data for this
Ligand-Target Pair