BDBM27580 8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-2-azatricyclo[8.4.0.0^{2,6}]tetradeca-1(14),3,5,10,12-pentaen-7-one::Pyrrolobenzoxazepinone (PBO), 5

SMILES: CCC1(Oc2ccccc2-n2cccc2C1=O)c1ccc(COc2cccc(Cl)c2)cc1

InChI Key: InChIKey=TWHRAFICIVSMBQ-UHFFFAOYSA-N

Data: 5 KI  4 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 9 hits for monomerid = 27580   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
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Reverse transcriptase protein (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
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Reverse transcriptase (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	100	n/a	n/a	n/a	n/a	n/a	n/a
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Reverse transcriptase protein (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	250	n/a	n/a	n/a	n/a	n/a	n/a
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Gag-Pol polyprotein [588-1027] (HIV-1-Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		100	-9.93	n/a	n/a	n/a	n/a	n/a	7.5	37
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Gag-Pol polyprotein [588-1127,L687I]/[588-1147,L687I] (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		250	-9.36	n/a	n/a	n/a	n/a	n/a	7.5	37
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Gag-Pol polyprotein [588-1027,K691N]/[588-1147,K690N] (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		300	-9.25	n/a	n/a	n/a	n/a	n/a	7.5	37
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Gag-Pol polyprotein [588-1027,V767D]/[588-1147,V767D] (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		300	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
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Gag-Pol polyprotein [588-1027,Y769I]/[588-1147,Y769I] (Human immunodeficiency virus type 1)	BDBM27580 (8-[4-(3-chlorophenoxymethyl)phenyl]-8-ethyl-9-oxa-...) Show SMILES Show InChI	GoogleScholar	UniChem		<1.00E+4	<-7.09	n/a	n/a	n/a	n/a	n/a	7.5	37
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