Compile Data Set for Download or QSAR

Found 65 hits with Last Name = 'cai' and Initial = 'sj'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547407 (CHEMBL4751262) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-c1nc(Cc2ccccc2F)n2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547430 (CHEMBL4753045) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(Cc2c(F)ccc(F)c2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547428 (CHEMBL4761962) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(Cc2ccccc2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547429 (CHEMBL4755974) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(Cc2c(F)ccc(F)c2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547417 (CHEMBL4793885) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cc(F)ccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547420 (CHEMBL4781791) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547436 (CHEMBL4788234) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCCC(F)(F)F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547427 (CHEMBL4789308) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547412 (CHEMBL4751235) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50547435 (CHEMBL4758823) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCC(F)(F)F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2C9 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547416 (CHEMBL4759918) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cccc(F)c2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547414 (CHEMBL4751496) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(ccc12)C#N Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547433 (CHEMBL4740488) Show SMILES CCCCCc1nn(-c2nc3NC(=O)C(C)(C)c3c(N)n2)c2ccc(Cl)cc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547431 (CHEMBL4778917) Show SMILES CCCc1nn(-c2nc3NC(=O)C(C)(C)c3c(N)n2)c2ccc(Cl)cc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547415 (CHEMBL4779699) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2Cl)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.09E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547432 (CHEMBL4752891) Show SMILES CCCCc1nn(-c2nc3NC(=O)C(C)(C)c3c(N)n2)c2ccc(Cl)cc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.23E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547422 (CHEMBL4762232) Show SMILES Nc1nc(nc2[nH]c(=O)[nH]c12)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547413 (CHEMBL4787520) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(F)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.51E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547408 (CHEMBL4763259) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-c1nc(Cc2ccccc2F)n2ncccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.61E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547418 (CHEMBL4740085) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cc(F)cc(F)c2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547435 (CHEMBL4758823) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCC(F)(F)F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547434 (CHEMBL4797904) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCC(F)(F)F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547426 (CHEMBL4744474) Show SMILES Nc1nc(nc2NC(=O)Cc12)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547425 (CHEMBL4789662) Show SMILES Cn1c2c(N)nc(nc2[nH]c1=O)-n1nc(Cc2ccccc2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547424 (CHEMBL4778128) Show SMILES CCn1c2c(N)nc(nc2[nH]c1=O)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547423 (CHEMBL4761586) Show SMILES Cn1c2c(N)nc(nc2[nH]c1=O)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547421 (CHEMBL4753214) Show SMILES COC(=O)Nc1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547419 (CHEMBL4800006) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547411 (CHEMBL4793528) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(OC)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547410 (CHEMBL4785740) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(C)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50547435 (CHEMBL4758823) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCC(F)(F)F)c2cc(Cl)ccc12 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2D6 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Potassium voltage-gated channel subfamily H member 2 (Homo sapiens (Human))	BDBM50547409 (CHEMBL4752570) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of human ERG				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50547435 (CHEMBL4758823) Show SMILES CC1(C)C(=O)Nc2nc(nc(N)c12)-n1nc(CCC(F)(F)F)c2cc(Cl)ccc12 Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP3A4 (unknown origin)				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547408 (CHEMBL4763259) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-c1nc(Cc2ccccc2F)n2ncccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547437 (CHEMBL4784447) Show SMILES CCCCCc1nc(C(=O)c2cccc3ccccc23)c2ccccn12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547410 (CHEMBL4785740) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(C)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.66E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547411 (CHEMBL4793528) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(OC)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.01E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547412 (CHEMBL4751235) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	350	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547413 (CHEMBL4787520) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(F)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	960	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547414 (CHEMBL4751496) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2F)c2cc(ccc12)C#N Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	4.30E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547415 (CHEMBL4779699) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2ccccc2Cl)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.71E+3	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547416 (CHEMBL4759918) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cccc(F)c2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547417 (CHEMBL4793885) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cc(F)ccc2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	270	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547418 (CHEMBL4740085) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2cc(F)cc(F)c2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	110	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547419 (CHEMBL4800006) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	270	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547420 (CHEMBL4781791) Show SMILES COC(=O)N(C)c1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	700	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547421 (CHEMBL4753214) Show SMILES COC(=O)Nc1c(N)nc(nc1N)-n1nc(Cc2c(F)ccc(F)c2F)c2cc(Cl)ccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	670	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547422 (CHEMBL4762232) Show SMILES Nc1nc(nc2[nH]c(=O)[nH]c12)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	300	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547423 (CHEMBL4761586) Show SMILES Cn1c2c(N)nc(nc2[nH]c1=O)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	120	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair
Guanylate cyclase soluble subunit alpha-1/beta-1 (Homo sapiens (Human))	BDBM50547424 (CHEMBL4778128) Show SMILES CCn1c2c(N)nc(nc2[nH]c1=O)-n1nc(Cc2ccccc2F)c2ccccc12 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	200	n/a	n/a	n/a	n/a
TBA					Assay Description Activation of human sGC subunit alpha1/beta1 expressed in CHO cells assessed as cGMP production by CASA assay				Citation and Details Article DOI: 10.1016/j.bmcl.2020.127574 BindingDB Entry DOI: 10.7270/Q2XG9VRF
					More data for this Ligand-Target Pair

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