BDBM183646 US9150519, 1-10

SMILES: Cc1cc(NC(=O)c2cc(NC3CCCCC3)ncn2)c(C)cc1O

InChI Key: InChIKey=OBCWOTVOBQQVEL-UHFFFAOYSA-N

Data: 1 KI  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 2 hits for monomerid = 183646   

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
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM183646 (US9150519, 1-10) Show SMILES Cc1cc(NC(=O)c2cc(NC3CCCCC3)ncn2)c(C)cc1O Show InChI InChI=1S/C19H24N4O2/c1-12-9-17(24)13(2)8-15(12)23-19(25)16-10-18(21-11-20-16)22-14-6-4-3-5-7-14/h8-11,14,24H,3-7H2,1-2H3,(H,23,25)(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	740	-7.77	n/a	n/a	n/a	n/a	n/a	7.4	4
MERCK SERONO SA US Patent					Assay Description Membranes were prepared from CHO cells expressing S1P1 or S1P3 for use in ligand and 35S-GTPgammaS binding studies. Cells were suspended in 50 mM TRI...				US Patent US9150519 (2015) BindingDB Entry DOI: 10.7270/Q2H993ZK
					More data for this Ligand-Target Pair
Sphingosine 1-phosphate receptor 1 (Homo sapiens (Human))	BDBM183646 (US9150519, 1-10) Show SMILES Cc1cc(NC(=O)c2cc(NC3CCCCC3)ncn2)c(C)cc1O Show InChI InChI=1S/C19H24N4O2/c1-12-9-17(24)13(2)8-15(12)23-19(25)16-10-18(21-11-20-16)22-14-6-4-3-5-7-14/h8-11,14,24H,3-7H2,1-2H3,(H,23,25)(H,20,21,22)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	n/a	n/a	1.44E+3	n/a	n/a	7.4	30
MERCK SERONO SA US Patent					Assay Description Measurements of 35S-GTPgammaS Binding: Membranes (1 to 10 µg protein) prepared as described above, were incubated in 96-well Scintiplates (PerkinElm...				US Patent US9150519 (2015) BindingDB Entry DOI: 10.7270/Q2H993ZK
					More data for this Ligand-Target Pair