Compile Data Set for Download or QSAR

Found 53 hits Enz. Inhib. hit(s) with all data for entry = 50014417   

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
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576017 (CHEMBL4552959) Show SMILES CCOC(=O)c1nnc(Nc2[nH]c3c(c(nn3c(=O)c2-c2ccc3ncccc3c2)-c2ccccc2)-c2ccccc2)o1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576014 (CHEMBL4521249) Show SMILES O=c1c(-c2ccc3ncccc3c2)c(Nc2cc[nH]n2)[nH]c2c(c(nn12)-c1ccccc1)C1=CCCCC1 |t:38| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576013 (CHEMBL4558617) Show SMILES COc1ccc(cc1)-c1c(Nc2cc[nH]n2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:35| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576015 (CHEMBL4582312) Show SMILES O=c1c(-c2ccc3ncccc3c2)c(Nc2cc[nH]n2)[nH]c2c(c(nn12)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576011 (CHEMBL4514699) Show SMILES Oc1ccc(cc1)-c1c(Nc2cc[nH]n2)[nH]c2c(c(nn2c1=O)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576019 (CHEMBL4568226) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575996 (CHEMBL4870597) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccc2OCOc2c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	8	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576018 (CHEMBL4585665) Show SMILES COc1ccc(cc1)-c1c(Nc2ccon2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:35| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576016 (CHEMBL4584451) Show SMILES CCOC(=O)n1ccc(Nc2[nH]c3c(c(nn3c(=O)c2-c2ccc(OC)cc2)-c2ccccc2)-c2ccccc2)n1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576012 (CHEMBL4559088) Show SMILES COc1ccc(cc1)-c1c(Nc2cc[nH]n2)[nH]c2c(c(nn2c1=O)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	14	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576002 (CHEMBL4590059) Show SMILES Cc1[nH]c2c(c(nn2c(=O)c1-c1ccc2ncccc2c1)-c1ccccc1)C1=CCCCC1 |t:32| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	25	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576020 (CHEMBL4529030) Show SMILES COc1ccc(cc1)-c1c(Nc2cnccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576000 (CHEMBL4587880) Show SMILES Cc1[nH]c2c(c(nn2c(=O)c1-c1ccc(O)cc1)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575997 (CHEMBL4549681) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccc2[nH]cnc2c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	45	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575999 (CHEMBL4483464) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccc2ncccc2c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575995 (CHEMBL4560666) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccc(O)cc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	57	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576001 (CHEMBL4561247) Show SMILES Cc1[nH]c2c(C3CCCCC3)c(nn2c(=O)c1-c1ccc2ncccc2c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	66	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575998 (CHEMBL4582351) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccc2[nH]c(N)nc2c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	83	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576004 (CHEMBL4552037) Show SMILES Cc1[nH]c2c(c(nn2c(=O)c1-c1ccc2ncccc2c1)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	97	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576005 (CHEMBL4856769) Show SMILES Cc1c(-c2ccc(O)cc2)c(=O)n2nc(c(N3CCCCC3)c2n1C)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576006 (CHEMBL4546944) Show SMILES Cc1c(-c2ccc3ncccc3c2)c(=O)n2nc(c(-c3ccccc3)c2n1C)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	120	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575992 (CHEMBL4525301) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccncc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575993 (CHEMBL4531472) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1cscn1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576003 (CHEMBL4551583) Show SMILES Cc1[nH]c2c(C3=CCCC3)c(nn2c(=O)c1-c1ccc2ncccc2c1)-c1ccccc1 |t:5| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	159	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575983 (CHEMBL4865263) Show SMILES Cc1cc(=O)n2nc(c(C3=CCCCC3)c2[nH]1)-c1ccccc1 |t:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575985 (CHEMBL4877839) Show SMILES Cc1cc(=O)n2nc(c(N3CCCCC3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576010 (CHEMBL4875209) Show SMILES O=c1cc(Nc2cc[nH]n2)[nH]c2c(c(nn12)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	270	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575984 (CHEMBL4875322) Show SMILES Cc1cc(=O)n2nc(c(C3CCCCC3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	660	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575982 (CHEMBL4866271) Show SMILES Cc1cc(=O)n2nc(c(C3CCCC3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	680	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
UDP-glucuronosyltransferase 1A1 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of UGT1A1 (unknown origin)				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575981 (CHEMBL4878283) Show SMILES Cc1cc(=O)n2nc(c(C3=CCCC3)c2[nH]1)-c1ccccc1 |t:9| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.14E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575994 (CHEMBL4541968) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1cn[nH]c1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.31E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575991 (CHEMBL4522713) Show SMILES Cc1[nH]c2c(N3CCCCC3)c(nn2c(=O)c1-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.34E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575977 (CHEMBL4859703) Show SMILES Cc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB 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 MAT2A (unknown origin) mass spectrometry-based ultrafiltration assay				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575977 (CHEMBL4859703) Show SMILES Cc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB 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 recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair				3D Structure (crystal)
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575986 (CHEMBL4866030) Show SMILES Cc1cc(=O)n2nc(-c3ccco3)c(-c3ccccc3)c2[nH]1 Show InChI	PDB UniProtKB/SwissProt 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 recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575990 (CHEMBL4854483) Show SMILES Cc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1cccc(F)c1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
Solute carrier organic anion transporter family member 1B1 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of OATP1B1 (unknown origin)				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575980 (CHEMBL4865666) Show SMILES Cc1cc(=O)n2nc(c(-c3ccco3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576007 (CHEMBL4539385) Show SMILES CCc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.66E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576008 (CHEMBL4872447) Show SMILES CC(=O)Nc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.11E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575979 (CHEMBL4862694) Show SMILES Cc1cc(=O)n2nc(c(-c3ccccn3)c2[nH]1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
Cytochrome P450 2C19 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of CYP2C19 (unknown origin)				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
Cytochrome P450 2D6 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+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: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
Cytochrome P450 2C9 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+4	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: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
Cytochrome P450 3A4 (Homo sapiens (Human))	BDBM50576021 (CHEMBL4573938) Show SMILES COc1ccc(cc1)-c1c(Nc2ccccn2)[nH]c2c(c(nn2c1=O)-c1ccccc1)C1=CCCCC1 |t:36| Show InChI	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	>1.00E+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: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575989 (CHEMBL4874436) Show SMILES Cc1cc(=O)n2nc(c(-c3ccccc3)c2[nH]1)-c1cccc(O)c1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.22E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50576009 (CHEMBL4857178) Show SMILES O=c1cc(Nc2ccccc2)[nH]c2c(c(nn12)-c1ccccc1)-c1ccccc1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.66E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair
S-adenosylmethionine synthase isoform type-2 (Human)	BDBM50575987 (CHEMBL4863546) Show SMILES Cc1cc(=O)n2nc(-c3cn[nH]c3)c(-c3ccccc3)c2[nH]1 Show InChI	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.01E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA					Assay Description Inhibition of recombinant human MAT2A expressed in baculovirus infected Sf9 cells assessed as S-adenosyl methionine production using L-methionine as ...				Citation and Details Article DOI: 10.1021/acs.jmedchem.0c01895 BindingDB Entry DOI: 10.7270/Q20R9T7P
					More data for this Ligand-Target Pair

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