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SMILES: C[N+](C)(C)CCCn1c(Cc2cc3OCOc3cc2I)nc2c(N)nc(F)nc12

InChI Key: InChIKey=SIUQHUOPTWUTKT-UHFFFAOYSA-N

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 406710   
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
Hsp90 co-chaperone Cdc37


(Homo sapiens (Human))		BDBM406710
PNG
(US10336757, Compound PU-BSI4)
Show SMILES C[N+](C)(C)CCCn1c(Cc2cc3OCOc3cc2I)nc2c(N)nc(F)nc12
Show InChI InChI=1S/C19H23FIN6O2/c1-27(2,3)6-4-5-26-15(23-16-17(22)24-19(20)25-18(16)26)8-11-7-13-14(9-12(11)21)29-10-28-13/h7,9H,4-6,8,10H2,1-3H3,(H2,22,24,25)/q+1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 95.3n/an/an/an/a



Sloan-Kettering Institute for Cancer Research

US Patent


Assay Description
The assay buffer (HFB) contained 20 mM HEPES (K) pH 7.3, 50 mM KCl, 5 mM MgCl2, 20 mM Na2MoO4, 0.01% NP40. Before each use, 0.1 mg/mL bovine gamma gl...

US Patent US10336757 (2019)


BindingDB Entry DOI: 10.7270/Q2VT1VF6
More data for this
Ligand-Target Pair