BDBM14299 benzthiazole analog 2::benzyl N-[(2S)-1-(1,3-benzothiazol-2-yl)-1-oxo-3-{1H-pyrrolo[3,2-c]pyridin-2-yl}propan-2-yl]carbamate

SMILES: O=C(N[C@@H](Cc1cc2cnccc2[nH]1)C(=O)c1nc2ccccc2s1)OCc1ccccc1

InChI Key: InChIKey=FYNQDMDQWGHUKH-NRFANRHFSA-N

Data: 2 KI

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 = 14299   

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
Trypsin (Bos taurus (bovine))	BDBM14299 (benzthiazole analog 2 | benzyl N-[(2S)-1-(1,3-benz...) Show SMILES O=C(N[C@@H](Cc1cc2cnccc2[nH]1)C(=O)c1nc2ccccc2s1)OCc1ccccc1 |r| Show InChI InChI=1S/C25H20N4O3S/c30-23(24-28-20-8-4-5-9-22(20)33-24)21(13-18-12-17-14-26-11-10-19(17)27-18)29-25(31)32-15-16-6-2-1-3-7-16/h1-12,14,21,27H,13,15H2,(H,29,31)/t21-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	6.90E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Celera					Assay Description Each enzyme was assayed with a set of different concentrations of each inhibitor. After addition of the appropriate substrate, the rate of hydrolysis...				Biochemistry 45: 5964-73 (2006) Article DOI: 10.1021/bi060173m BindingDB Entry DOI: 10.7270/Q2W09450
					More data for this Ligand-Target Pair
Tryptase (Homo sapiens (Human))	BDBM14299 (benzthiazole analog 2 | benzyl N-[(2S)-1-(1,3-benz...) Show SMILES O=C(N[C@@H](Cc1cc2cnccc2[nH]1)C(=O)c1nc2ccccc2s1)OCc1ccccc1 |r| Show InChI InChI=1S/C25H20N4O3S/c30-23(24-28-20-8-4-5-9-22(20)33-24)21(13-18-12-17-14-26-11-10-19(17)27-18)29-25(31)32-15-16-6-2-1-3-7-16/h1-12,14,21,27H,13,15H2,(H,29,31)/t21-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	1.20E+4	-6.64	n/a	n/a	n/a	n/a	n/a	7.4	22
Celera					Assay Description Each enzyme was assayed with a set of different concentrations of each inhibitor. After addition of the appropriate substrate, the rate of hydrolysis...				Biochemistry 45: 5964-73 (2006) Article DOI: 10.1021/bi060173m BindingDB Entry DOI: 10.7270/Q2W09450
					More data for this Ligand-Target Pair