BDBM82191 Substrate analogue, 8

SMILES: CC(=O)CCC(O)=O

InChI Key: InChIKey=JOOXCMJARBKPKM-UHFFFAOYSA-N

Data: 2 KI

PDB links: 8 PDB IDs match this monomer.

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 = 82191   

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
Solute carrier family 15 member 2 (Homo sapiens (Human))	BDBM82191 (Substrate analogue, 8) Show SMILES CC(=O)CCC(O)=O Show InChI InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)	PDB Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	Purchase DrugBank MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	2.30E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ degli Studi di Milano Curated by ChEMBL					Assay Description Binding affinity to human PepT2 in SKTP cells				Bioorg Med Chem 19: 4544-51 (2011) Article DOI: 10.1016/j.bmc.2011.06.027 BindingDB Entry DOI: 10.7270/Q2MP549P
					More data for this Ligand-Target Pair
Porphobilinogen synthase (Escherichia coli)	BDBM82191 (Substrate analogue, 8) Show SMILES CC(=O)CCC(O)=O Show InChI InChI=1S/C5H8O3/c1-4(6)2-3-5(7)8/h2-3H2,1H3,(H,7,8)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase DrugBank MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	2.20E+6	-3.77	n/a	n/a	n/a	n/a	n/a	8.1	37
University of Neuchâtel					Assay Description The PBGS assay is a colorimetric assay based on the reaction between PBG and 4-dimethylaminobenzaldehyde (Ehrlich's reagent).				Chembiochem 2: 343-54 (2001) Article DOI: 10.1002/1439-7633(20010504)2 BindingDB Entry DOI: 10.7270/Q29Z93CN
					More data for this Ligand-Target Pair