BDBM269909 (1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-hydroxy-2-propanesulfonamide or (1S,2R)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-(6-methoxy-2-pyridinyl)-4H-1,2,4-triazol-3-yl)-1-hydroxy-2-propanesulfonamide::US10058550, Example 442.0::US10058550, Example 443.0::US10221162, Example 443.0::US9845310, Example 443.0

SMILES: COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC

InChI Key: InChIKey=PTHHQNYABZAMTJ-WAIKUNEKSA-N

Data: 6 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 6 hits for monomerid = 269909   

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
Apelin receptor (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	13	n/a	n/a	7.5	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV¿-3 expression vector (Si...				US Patent US10058550 (2018) BindingDB Entry DOI: 10.7270/Q26T0PP0
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.5	n/a	n/a	7.5	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV¿-3 expression vector (Si...				US Patent US10058550 (2018) BindingDB Entry DOI: 10.7270/Q26T0PP0
					More data for this Ligand-Target Pair
Apelin receptor (APJ) (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.5	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV-3 expression vector (Sig...				US Patent US9845310 (2017) BindingDB Entry DOI: 10.7270/Q28P62TV
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	2.5	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10221162 (2019) BindingDB Entry DOI: 10.7270/Q2ZK5JXS
					More data for this Ligand-Target Pair
Apelin receptor (APJ) (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV-3 expression vector (Sig...				US Patent US9845310 (2017) BindingDB Entry DOI: 10.7270/Q28P62TV
					More data for this Ligand-Target Pair
Apelin receptor (Homo sapiens (Human))	BDBM269909 ((1R,2S)-1-cyclohexyl-N-(4-(2,6-dimethoxyphenyl)-5-...) Show SMILES COc1cccc(n1)-c1nnc(NS(=O)(=O)[C@H](C)[C@@H](O)C2CCCCC2)n1-c1c(OC)cccc1OC |r,wD:16.17,18.19,(-8.96,-8.33,;-7.48,-8.73,;-6.39,-7.64,;-6.79,-6.16,;-5.7,-5.07,;-4.21,-5.47,;-3.81,-6.95,;-4.9,-8.04,;-2.32,-7.35,;-1.85,-8.82,;-.31,-8.82,;.17,-7.35,;1.5,-6.58,;2.84,-7.35,;2.07,-8.69,;3.61,-8.69,;4.17,-6.58,;4.17,-5.04,;5.5,-7.35,;5.5,-8.89,;6.84,-6.58,;8.17,-7.35,;9.5,-6.58,;9.5,-5.04,;8.17,-4.27,;6.84,-5.04,;-1.08,-6.45,;-1.08,-4.91,;-2.41,-4.14,;-3.74,-4.91,;-5.08,-4.14,;-2.41,-2.6,;-1.08,-1.83,;.26,-2.6,;.26,-4.14,;1.59,-4.91,;2.92,-4.14,)| Show InChI InChI=1S/C25H33N5O6S/c1-16(23(31)17-10-6-5-7-11-17)37(32,33)29-25-28-27-24(18-12-8-15-21(26-18)36-4)30(25)22-19(34-2)13-9-14-20(22)35-3/h8-9,12-17,23,31H,5-7,10-11H2,1-4H3,(H,28,29)/t16-,23-/m1/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	KEGG PC cid PC sid UniChem	US Patent	n/a	n/a	n/a	n/a	13	n/a	n/a	n/a	n/a
AMGEN INC. US Patent					Assay Description The human APJ receptor was cloned by polymerase chain reaction and the gene encoding the receptor was subcloned in pFLAG-CMV™-3 expression vector (Si...				US Patent US10221162 (2019) BindingDB Entry DOI: 10.7270/Q2ZK5JXS
					More data for this Ligand-Target Pair