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BDBM50222130 CHEMBL314586

SMILES: COC1\C=C\OC2(C)Oc3c(C2=O)c2cc(\C=N\N4CCCCCCC4)c(NC(=O)\C(C)=C/C=C/C(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C)c(O)c2c(O)c3C

InChI Key: InChIKey=AIADWVYDCVXWMW-KURPDETFSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50222130   
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
Simian sarcoma virus Pol protein


(Woolly monkey sarcoma virus)		BDBM50222130
PNG
(CHEMBL314586)
Show SMILES COC1\C=C\OC2(C)Oc3c(C2=O)c2cc(\C=N\N4CCCCCCC4)c(NC(=O)\C(C)=C/C=C/C(C)C(O)C(C)C(O)C(C)C(OC(C)=O)C1C)c(O)c2c(O)c3C |c:33,t:3,35|
Show InChI InChI=1S/C45H61N3O11/c1-24-16-15-17-25(2)44(55)47-36-31(23-46-48-19-13-11-10-12-14-20-48)22-32-34(40(36)53)39(52)29(6)42-35(32)43(54)45(8,59-42)57-21-18-33(56-9)26(3)41(58-30(7)49)28(5)38(51)27(4)37(24)50/h15-18,21-24,26-28,33,37-38,41,50-53H,10-14,19-20H2,1-9H3,(H,47,55)/b16-15+,21-18+,25-17-,46-23+
KEGG

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars
PubMed
 5.89E+7n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to inhibit simian virus reverse transcriptase, expressed as log Ki.

J Med Chem 23: 256-61 (1980)


BindingDB Entry DOI: 10.7270/Q2XD10PG
More data for this
Ligand-Target Pair