BDBM50537822 CHEMBL4632364

SMILES: [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cccc3ccccc13)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC

InChI Key: InChIKey=QJMJRWFADOGSFW-RWFFFURRSA-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 = 50537822   

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
Coagulation factor X (Homo sapiens (Human))	BDBM50537822 (CHEMBL4632364) Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C[C@H]3OCc1cn(nn1)-c1cccc3ccccc13)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:6:1.3.2| Show InChI InChI=1S/C35H45N3O3/c1-5-40-31(39)34(4)17-9-16-33(3)28(34)15-19-35-20-30(32(2,23-35)18-14-29(33)35)41-22-25-21-38(37-36-25)27-13-8-11-24-10-6-7-12-26(24)27/h6-8,10-13,21,28-30H,5,9,14-20,22-23H2,1-4H3/t28-,29-,30+,32-,33+,34+,35-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	PubMed	n/a	n/a	4.87E+3	n/a	n/a	n/a	n/a	n/a	n/a
Peking University Curated by ChEMBL					Assay Description Inhibition of factor 10a (unknown origin)				Bioorg Med Chem Lett 30: (2020)
					More data for this Ligand-Target Pair