BDBM290099 US9573961, Example 84::US9573961, Example 85

SMILES: C[C@@H]1Cc2cc(ccc2C(=O)O1)[C@@H]1CN2CCN(C[C@H]2CO1)C(=O)C1CCc2cc(ccc12)-n1cnnn1

InChI Key: InChIKey=MDGCZENOUYCMOW-PCYOSGLOSA-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 = 290099   

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
ATP-sensitive inward rectifier potassium channel 1 (Homo sapiens (Human))	BDBM290099 (US9573961, Example 84 | US9573961, Example 85) Show SMILES C[C@@H]1Cc2cc(ccc2C(=O)O1)[C@@H]1CN2CCN(C[C@H]2CO1)C(=O)C1CCc2cc(ccc12)-n1cnnn1 |r| Show InChI InChI=1S/C28H30N6O4/c1-17-10-20-11-19(3-5-24(20)28(36)38-17)26-14-32-8-9-33(13-22(32)15-37-26)27(35)25-6-2-18-12-21(4-7-23(18)25)34-16-29-30-31-34/h3-5,7,11-12,16-17,22,25-26H,2,6,8-10,13-15H2,1H3/t17-,22+,25?,26+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	150	n/a	n/a	n/a	n/a	7.4	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks Qu...				US Patent US9573961 (2017) BindingDB Entry DOI: 10.7270/Q241704N
					More data for this Ligand-Target Pair
ATP-sensitive inward rectifier potassium channel 1 (Homo sapiens (Human))	BDBM290099 (US9573961, Example 84 | US9573961, Example 85) Show SMILES C[C@@H]1Cc2cc(ccc2C(=O)O1)[C@@H]1CN2CCN(C[C@H]2CO1)C(=O)C1CCc2cc(ccc12)-n1cnnn1 |r| Show InChI InChI=1S/C28H30N6O4/c1-17-10-20-11-19(3-5-24(20)28(36)38-17)26-14-32-8-9-33(13-22(32)15-37-26)27(35)25-6-2-18-12-21(4-7-23(18)25)34-16-29-30-31-34/h3-5,7,11-12,16-17,22,25-26H,2,6,8-10,13-15H2,1H3/t17-,22+,25?,26+/m1/s1	Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	400	n/a	n/a	n/a	n/a	7.4	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Block of Kir1.1 (ROMK1) currents was examined by whole cell voltage clamp (Hamill et. al. Pfluegers Archives 391:85-100 (1981)) using the IonWorks Qu...				US Patent US9573961 (2017) BindingDB Entry DOI: 10.7270/Q241704N
					More data for this Ligand-Target Pair