null

SMILES: C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O

InChI Key: InChIKey=BSFXXKHCUFPVSC-ONGXEEELSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50452047   

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
Retinoic acid receptor RXR-beta (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	12	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-RA from Retinoic X receptor beta				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	19	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity against Retinoic acid receptor RXR-alpha by [3H]-9-cis-RA displacement.				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-gamma (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	29	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Displacement of [3H]-9-cis-RA from retinoic X receptor gamma				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-gamma (Mus musculus)	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity against retinoic acid receptor gamma by [3H]-ATRA displacement.				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor alpha (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity against retinoic acid receptor alpha by [3H]-ATRA displacement.				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-beta (Mus musculus)	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity again retinoic acid receptor beta by [3H]-ATRA displacement.				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Binding affinity against Retinoic acid receptor RXR-alpha by [3H]-9-cis-RA displacement.				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair
Retinoic acid receptor RXR-alpha (Homo sapiens (Human))	BDBM50452047 (CHEMBL2372524) Show SMILES C[C@H](NC(=O)[C@H](Cc1ccccc1)NP(O)(O)=O)C(=O)NCC(N)=O |r| Show InChI InChI=1S/C14H21N4O6P/c1-9(13(20)16-8-12(15)19)17-14(21)11(18-25(22,23)24)7-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3,(H2,15,19)(H,16,20)(H,17,21)(H3,18,22,23,24)/t9-,11-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	86	n/a	n/a	n/a	n/a
Ligand Pharmaceuticals Inc Curated by ChEMBL					Assay Description Transcriptional activation in CV-1 cells expressing Retinoid X receptor alpha				Bioorg Med Chem Lett 14: 1593-8 (2004) Article DOI: 10.1016/j.bmcl.2003.12.089 BindingDB Entry DOI: 10.7270/Q2B857JF
					More data for this Ligand-Target Pair