BDBM50045402 3,17-Dihydroxy-10,13-dimethyl-1,4,6,7,8,9,10,11,12,13,14,15,16,17-tetradecahydro-20-oxa-cyclopropa[4,5]cyclopenta[a]phenanthrene-2-carboxylic acid amide::CHEMBL92554

SMILES: C[C@]12CCC3C(CC[C@]45OC4C(=O)C(C[C@]35C)C(N)=O)C1CC[C@@H]2O

InChI Key: InChIKey=PJPCXOXBOKWIJL-OHNFMIHVSA-N

Data: 1 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 1 hit for monomerid = 50045402   

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
Human immunodeficiency virus type 1 Tat protein (Human immunodeficiency virus type 1 (isolate PCV12...)	BDBM50045402 (3,17-Dihydroxy-10,13-dimethyl-1,4,6,7,8,9,10,11,12...) Show SMILES C[C@]12CCC3C(CC[C@]45OC4C(=O)C(C[C@]35C)C(N)=O)C1CC[C@@H]2O Show InChI InChI=1S/C20H29NO4/c1-18-7-6-13-10(12(18)3-4-14(18)22)5-8-20-16(25-20)15(23)11(17(21)24)9-19(13,20)2/h10-14,16,22H,3-9H2,1-2H3,(H2,21,24)/t10?,11?,12?,13?,14-,16?,18-,19+,20-/m0/s1	PDB MMDB Reactome pathway UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.43E+4	n/a	n/a	n/a	n/a	n/a	n/a
Sterling Winthrop Pharmaceuticals Research Division Curated by ChEMBL					Assay Description Inhibition of HIV-1 nuclear regulatory protein Tat				J Med Chem 36: 2701-2 (1993) BindingDB Entry DOI: 10.7270/Q2NG4PP3
					More data for this Ligand-Target Pair