BDBM50329603 CHEMBL1270532::N-(Piperidino-1-ethyl)-1-[4-(aminosulfonyl)phenyl]-2-methyl-5-(2-naphthyl)-1H-pyrrole-3-carboxamide

SMILES: Cc1c(cc(-c2ccc3ccccc3c2)n1-c1ccc(cc1)S(N)(=O)=O)C(=O)NCCN1CCCCC1

InChI Key: InChIKey=QIWATSSWAUUSFM-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50329603   

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
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50329603 (CHEMBL1270532 | N-(Piperidino-1-ethyl)-1-[4-(amino...) Show SMILES Cc1c(cc(-c2ccc3ccccc3c2)n1-c1ccc(cc1)S(N)(=O)=O)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C29H32N4O3S/c1-21-27(29(34)31-15-18-32-16-5-2-6-17-32)20-28(24-10-9-22-7-3-4-8-23(22)19-24)33(21)25-11-13-26(14-12-25)37(30,35)36/h3-4,7-14,19-20H,2,5-6,15-18H2,1H3,(H,31,34)(H2,30,35,36)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	9	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 2 by stopped flow CO2 hydration assay				Bioorg Med Chem 18: 7392-401 (2010) Article DOI: 10.1016/j.bmc.2010.09.007 BindingDB Entry DOI: 10.7270/Q23T9HGQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50329603 (CHEMBL1270532 | N-(Piperidino-1-ethyl)-1-[4-(amino...) Show SMILES Cc1c(cc(-c2ccc3ccccc3c2)n1-c1ccc(cc1)S(N)(=O)=O)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C29H32N4O3S/c1-21-27(29(34)31-15-18-32-16-5-2-6-17-32)20-28(24-10-9-22-7-3-4-8-23(22)19-24)33(21)25-11-13-26(14-12-25)37(30,35)36/h3-4,7-14,19-20H,2,5-6,15-18H2,1H3,(H,31,34)(H2,30,35,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	125	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 9 by stopped flow CO2 hydration assay				Bioorg Med Chem 18: 7392-401 (2010) Article DOI: 10.1016/j.bmc.2010.09.007 BindingDB Entry DOI: 10.7270/Q23T9HGQ
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50329603 (CHEMBL1270532 | N-(Piperidino-1-ethyl)-1-[4-(amino...) Show SMILES Cc1c(cc(-c2ccc3ccccc3c2)n1-c1ccc(cc1)S(N)(=O)=O)C(=O)NCCN1CCCCC1 Show InChI InChI=1S/C29H32N4O3S/c1-21-27(29(34)31-15-18-32-16-5-2-6-17-32)20-28(24-10-9-22-7-3-4-8-23(22)19-24)33(21)25-11-13-26(14-12-25)37(30,35)36/h3-4,7-14,19-20H,2,5-6,15-18H2,1H3,(H,31,34)(H2,30,35,36)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	479	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Univ Lille Nord de France Curated by ChEMBL					Assay Description Inhibition of human carbonic anhydrase 1 by stopped flow CO2 hydration assay				Bioorg Med Chem 18: 7392-401 (2010) Article DOI: 10.1016/j.bmc.2010.09.007 BindingDB Entry DOI: 10.7270/Q23T9HGQ
					More data for this Ligand-Target Pair