BindingDB logo
myBDB logout

BDBM130081 US8815901, 155

SMILES: COc1cc(OC)c(Cl)c(c1F)-c1ccc(C(=O)Nc2ncc(CN3CCNC(=O)C3)[nH]2)c2nccnc12

InChI Key: InChIKey=HKNCLTAHXPLYKK-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 = 130081   
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
Fibroblast growth factor receptor 3


(Homo sapiens (Human))
BDBM130081
PNG
(US8815901, 155)
Show SMILES COc1cc(OC)c(Cl)c(c1F)-c1ccc(C(=O)Nc2ncc(CN3CCNC(=O)C3)[nH]2)c2nccnc12 |(8.7,3.96,;9.47,2.62,;8.7,1.29,;9.47,-.04,;8.7,-1.38,;9.47,-2.71,;11.01,-2.71,;7.16,-1.38,;6.39,-2.71,;6.39,-.04,;7.16,1.29,;6.39,2.62,;4.85,-.04,;4.08,1.29,;2.54,1.29,;1.77,-.04,;.23,-.04,;-.54,1.29,;-.54,-1.38,;-2.08,-1.38,;-2.98,-.13,;-4.45,-.61,;-4.45,-2.15,;-5.78,-2.92,;-7.11,-2.15,;-7.11,-.61,;-8.45,.16,;-9.78,-.61,;-9.78,-2.15,;-11.12,-2.92,;-8.45,-2.92,;-2.98,-2.62,;2.54,-1.38,;1.77,-2.71,;2.54,-4.05,;4.08,-4.05,;4.85,-2.71,;4.08,-1.38,)|
Show InChI InChI=1S/C25H23ClFN7O4/c1-37-16-9-17(38-2)21(27)19(20(16)26)14-3-4-15(23-22(14)29-5-6-30-23)24(36)33-25-31-10-13(32-25)11-34-8-7-28-18(35)12-34/h3-6,9-10H,7-8,11-12H2,1-2H3,(H,28,35)(H2,31,32,33,36)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

US Patent
n/an/a 12n/an/an/an/an/a25



Novartis AG

US Patent


Assay Description
The assay has been run at room temperature on a liquid handling robot. To the assay plates containing 50 mL compound or control solutions, 4.5 uL of ...


US Patent US8815901 (2014)


BindingDB Entry DOI: 10.7270/Q2XG9PT8
More data for this
Ligand-Target Pair