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SMILES: CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](CO)C[C@@H]1CCNC1=O

InChI Key: InChIKey=GSBKVKSQMQMPOW-IHRRRGAJSA-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 2 hits for monomerid = 423459   
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
Replicase polyprotein 1ab


(SARS coronavirus Urbani)
BDBM423459
PNG
(WO2006061714, Example 1 | WO2006061714-ID-01)
Show SMILES CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](CO)C[C@@H]1CCNC1=O
Show InChI InChI=1S/C18H33N3O5/c1-11(2)8-14(21-17(25)26-18(3,4)5)16(24)20-13(10-22)9-12-6-7-19-15(12)23/h11-14,22H,6-10H2,1-5H3,(H,19,23)(H,20,24)(H,21,25)/t12-,13-,14-/m0/s1
PDB

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
WIPO
n/an/an/an/a>1.00E+8n/an/an/an/a



Pfizer Inc.



Assay Description
Proteolytic activity of Coronavirus 3C protease is measured using a continuous fluorescence resonance energy transfer assay. The SARS 3CI_pro FRET as...


WIPO (2006)

More data for this
Ligand-Target Pair
Replicase polyprotein 1ab


(Human SARS coronavirus (SARS-CoV) (Severe acute re...)
BDBM423459
PNG
(WO2006061714, Example 1 | WO2006061714-ID-01)
Show SMILES CC(C)C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@H](CO)C[C@@H]1CCNC1=O
Show InChI InChI=1S/C18H33N3O5/c1-11(2)8-14(21-17(25)26-18(3,4)5)16(24)20-13(10-22)9-12-6-7-19-15(12)23/h11-14,22H,6-10H2,1-5H3,(H,19,23)(H,20,24)(H,21,25)/t12-,13-,14-/m0/s1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
WIPO
n/an/an/an/a>1.00E+5n/an/an/an/a



Pfizer Inc.



Assay Description
Protection from SARS Infection: Neutral Red Endpoint The ability of compounds to protect cells against infection by the SARS coronavirus is measured ...


WIPO (2005)


BindingDB Entry DOI: 10.7270/Q2PV6NRF
More data for this
Ligand-Target Pair