BDBM22623 2-[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]-N-[(4-fluorophenyl)methyl]-5-hydroxy-1-methyl-6-oxo-1,6-dihydropyrimidine-4-carboxamide::N-Me-pyrimidone deriv., 22

SMILES: CN1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C

InChI Key: InChIKey=MBSMKNIEBKYDJI-STQMWFEESA-N

Data: 2 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 2 hits for monomerid = 22623   

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
Integrase (Human immunodeficiency virus 1)	BDBM22623 (2-[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]-N-[(4...) Show SMILES CN1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r| Show InChI InChI=1S/C18H20F2N4O3/c1-23-9-12(20)7-13(23)16-22-14(15(25)18(27)24(16)2)17(26)21-8-10-3-5-11(19)6-4-10/h3-6,12-13,25H,7-9H2,1-2H3,(H,21,26)/t12-,13-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
IRBM-MRL Curated by ChEMBL					Assay Description Inhibition of HIV 1 recombinant integrase				Bioorg Med Chem Lett 20: 5031-4 (2010) Article DOI: 10.1016/j.bmcl.2010.07.042 BindingDB Entry DOI: 10.7270/Q2D50QTH
					More data for this Ligand-Target Pair
Gag-Pol polyprotein (Human immunodeficiency virus type 1 group M subtyp...)	BDBM22623 (2-[(2S,4S)-4-fluoro-1-methylpyrrolidin-2-yl]-N-[(4...) Show SMILES CN1C[C@@H](F)C[C@H]1c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)n1C |r| Show InChI InChI=1S/C18H20F2N4O3/c1-23-9-12(20)7-13(23)16-22-14(15(25)18(27)24(16)2)17(26)21-8-10-3-5-11(19)6-4-10/h3-6,12-13,25H,7-9H2,1-2H3,(H,21,26)/t12-,13-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	7.8	37
IRBM-MRL					Assay Description The microtiter plate assay for stand transfer was performed with an immobilized donor substrate and a target substrate biotinylated at the 3-prime en...				J Med Chem 50: 4953-75 (2007) Article DOI: 10.1021/jm0704705 BindingDB Entry DOI: 10.7270/Q2BZ64BS
					More data for this Ligand-Target Pair