BDBM279204 US10035760, Example 29

SMILES: CN(C(=O)[C@H](Cc1ccccc1)NC(=O)NS(=O)(=O)c1ccccc1Br)c1ccc2OCOc2c1

InChI Key: InChIKey=WWOWZNKADJPMQU-IBGZPJMESA-N

Data: 1 EC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 279204   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 (isolate BRU/L...)	BDBM279204 (US10035760, Example 29) Show SMILES CN(C(=O)[C@H](Cc1ccccc1)NC(=O)NS(=O)(=O)c1ccccc1Br)c1ccc2OCOc2c1 |r| Show InChI InChI=1S/C24H22BrN3O6S/c1-28(17-11-12-20-21(14-17)34-15-33-20)23(29)19(13-16-7-3-2-4-8-16)26-24(30)27-35(31,32)22-10-6-5-9-18(22)25/h2-12,14,19H,13,15H2,1H3,(H2,26,27,30)/t19-/m0/s1	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<100	n/a	n/a	n/a	n/a
ViiV HEALTHCARE UK (NO. 5) LIMITED US Patent					Assay Description HIV cell culture assay¿MT-2 cells, 293T cells and the proviral DNA clone of NL4-3 virus were obtained from the NIH AIDS Research and Reference Reagen...				US Patent US10035760 (2018) BindingDB Entry DOI: 10.7270/Q2HT2RBW
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