BDBM396274 US10314827, Compound 23

SMILES: C[C@@H]1[C@H]2[C@@H](C[C@H](C)CN2CCNC(=O)CCc2ccccc2)O[C@]11CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC2=C(C)C1

InChI Key: InChIKey=HHOWGVDHVVHNIB-AKKZJJRISA-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 = 396274   

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
Alkaline phosphatase placental-like (Homo sapiens (Human))	BDBM396274 (US10314827, Compound 23) Show SMILES C[C@@H]1[C@H]2[C@@H](C[C@H](C)CN2CCNC(=O)CCc2ccccc2)O[C@]11CC[C@H]2[C@@H]3CC[C@@H]4CC(=O)CC[C@]4(C)[C@H]3CC2=C(C)C1 |r,t:46| Show InChI InChI=1S/C39H56N2O3/c1-25-20-35-37(41(24-25)19-18-40-36(43)13-10-28-8-6-5-7-9-28)27(3)39(44-35)17-15-31-32-12-11-29-21-30(42)14-16-38(29,4)34(32)22-33(31)26(2)23-39/h5-9,25,27,29,31-32,34-35,37H,10-24H2,1-4H3,(H,40,43)/t25-,27+,29+,31-,32-,34-,35+,37-,38-,39-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	<20	n/a	n/a	n/a	n/a
Boehringer Ingelheim Pharmaceuticals Inc.					Assay Description C3H10T1/2 cells were plated in 96 wells with a density of 8×103 cells/well. Cells were grown to confluence (72 hrs). After sonic Hedgehog (250 ng/ml)...				Bioorg Med Chem Lett 18: 1994-9 (2008) BindingDB Entry DOI: 10.7270/Q2QR50GW
					More data for this Ligand-Target Pair