BindingDB logo
myBDB logout

null

SMILES: Cc1c(Cl)ccc2n(C\C=C\[C@H]3NCCC[C@@H]3O)cnc12

InChI Key: InChIKey=SHEDFURMMHJNRY-LNMOPNHASA-N

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 = 493472   
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
Ribose-phosphate pyrophosphokinase 1


(Homo sapiens (Human))		BDBM493472
PNG
(US10981917, Example 173)
Show SMILES Cc1c(Cl)ccc2n(C\C=C\[C@H]3NCCC[C@@H]3O)cnc12 |r|
Show InChI InChI=1S/C16H20ClN3O/c1-11-12(17)6-7-14-16(11)19-10-20(14)9-3-4-13-15(21)5-2-8-18-13/h3-4,6-7,10,13,15,18,21H,2,5,8-9H2,1H3/b4-3+/t13-,15+/m1/s1
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 300n/an/an/an/an/an/a



Daewoong Pharmaceutical Co., Ltd.

US Patent


Assay Description
In order to confirm the biological activities of the compounds prepared in Examples, % inhibition or IC50 values of PRS enzyme (phosphoribosylpyropho...

US Patent US10981917 (2021)

More data for this
Ligand-Target Pair