BDBM272520 US10065953, Example 2

SMILES: Cc1ccc(cc1)-c1cccc(c1)-c1cn2c(N3CCC(C)(C)CC3)c([C@H](OC(C)(C)C)C(O)=O)c(C)cc2n1

InChI Key: InChIKey=TVXVAKNBTVTYLW-PMERELPUSA-N

Data: 1 EC50

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 = 272520   

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...)	BDBM272520 (US10065953, Example 2) Show SMILES Cc1ccc(cc1)-c1cccc(c1)-c1cn2c(N3CCC(C)(C)CC3)c([C@H](OC(C)(C)C)C(O)=O)c(C)cc2n1 |r| Show InChI InChI=1S/C34H41N3O3/c1-22-11-13-24(14-12-22)25-9-8-10-26(20-25)27-21-37-28(35-27)19-23(2)29(30(32(38)39)40-33(3,4)5)31(37)36-17-15-34(6,7)16-18-36/h8-14,19-21,30H,15-18H2,1-7H3,(H,38,39)/t30-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	32	n/a	n/a	n/a	n/a
ViiV HEALTHCARE UK (NO.5) LIMITED US Patent					Assay Description A recombinant NL-Rluc virus was constructed in which a section of the nef gene from NL4-3 was replaced with the Renilla Luciferase gene. The NL-RLuc ...				US Patent US10065953 (2018) BindingDB Entry DOI: 10.7270/Q2WD42KS
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