BindingDB logo
myBDB logout

BDBM50033942 5-Ethyl-1-[4-(3-trifluoromethyl-phenyl)-thiazol-2-yl]-1H-pyrazole-4-carboxylic acid (3-hydroxy-propyl)-amide::CHEMBL10101

SMILES: CCc1c(cnn1-c1nc(cs1)-c1cccc(c1)C(F)(F)F)C(=O)NCCCO

InChI Key: InChIKey=MKKMTLJJZXKVQU-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50033942   
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
Integrin alpha-L/beta-2


(Homo sapiens (Human))
BDBM50033942
PNG
(5-Ethyl-1-[4-(3-trifluoromethyl-phenyl)-thiazol-2-...)
Show SMILES CCc1c(cnn1-c1nc(cs1)-c1cccc(c1)C(F)(F)F)C(=O)NCCCO
Show InChI InChI=1S/C19H19F3N4O2S/c1-2-16-14(17(28)23-7-4-8-27)10-24-26(16)18-25-15(11-29-18)12-5-3-6-13(9-12)19(20,21)22/h3,5-6,9-11,27H,2,4,7-8H2,1H3,(H,23,28)
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 3.00E+3n/an/an/an/an/an/a



R.W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of HL-60 cell adhesion to purified ICAM-1 by LFA-1


J Med Chem 38: 1057-9 (1995)


BindingDB Entry DOI: 10.7270/Q2DJ5DPP
More data for this
Ligand-Target Pair