BDBM50284412 2-{[Acetyl-((2S,4S)-4-hexadecylcarbamoyloxymethyl-thietan-2-ylmethoxycarbonyl)-amino]-methyl}-1-ethyl-pyridinium; chloride::CHEMBL12183

SMILES: CCCCCCCCCCCCCCCCNC(=O)OC[C@@H]1C[C@@H](COC(=O)N(Cc2cccc[n+]2CC)C(C)=O)S1

InChI Key: InChIKey=AFNHHRFMFQNPDF-CONSDPRKSA-O

Data: 1 KI  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 2 hits for monomerid = 50284412   

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
Platelet activating factor receptor (Cavia porcellus)	BDBM50284412 (2-{[Acetyl-((2S,4S)-4-hexadecylcarbamoyloxymethyl-...) Show SMILES CCCCCCCCCCCCCCCCNC(=O)OC[C@@H]1C[C@@H](COC(=O)N(Cc2cccc[n+]2CC)C(C)=O)S1 Show InChI InChI=1S/C33H55N3O5S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-19-22-34-32(38)40-26-30-24-31(42-30)27-41-33(39)36(28(3)37)25-29-21-18-20-23-35(29)5-2/h18,20-21,23,30-31H,4-17,19,22,24-27H2,1-3H3/p+1/t30-,31-/m0/s1	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	9.80	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro ability to displace [3H]-PAF from PAF receptor in rabbit platelet membranes				Bioorg Med Chem Lett 5: 1097-1102 (1995) Article DOI: 10.1016/0960-894X(95)00174-R BindingDB Entry DOI: 10.7270/Q2NZ87KQ
					More data for this Ligand-Target Pair
Platelet activating factor receptor (Cavia porcellus)	BDBM50284412 (2-{[Acetyl-((2S,4S)-4-hexadecylcarbamoyloxymethyl-...) Show SMILES CCCCCCCCCCCCCCCCNC(=O)OC[C@@H]1C[C@@H](COC(=O)N(Cc2cccc[n+]2CC)C(C)=O)S1 Show InChI InChI=1S/C33H55N3O5S/c1-4-6-7-8-9-10-11-12-13-14-15-16-17-19-22-34-32(38)40-26-30-24-31(42-30)27-41-33(39)36(28(3)37)25-29-21-18-20-23-35(29)5-2/h18,20-21,23,30-31H,4-17,19,22,24-27H2,1-3H3/p+1/t30-,31-/m0/s1	MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article	n/a	n/a	21	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description In vitro inhibitory activity against PAF-induced aggregation of rabbit platelets				Bioorg Med Chem Lett 5: 1097-1102 (1995) Article DOI: 10.1016/0960-894X(95)00174-R BindingDB Entry DOI: 10.7270/Q2NZ87KQ
					More data for this Ligand-Target Pair