BDBM50146805 CHEMBL97951::[(cyclohexylmethyl)amino]carbonylphosphonic acid

SMILES: OP(O)(=O)C(=O)NCC1CCCCC1

InChI Key: InChIKey=XBMRQHZMWARLEG-UHFFFAOYSA-N

Data: 10 IC50

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 10 hits for monomerid = 50146805   

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
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description In vitro inhibitory activity against recombinant matrix metalloprotease-2 was determined				J Med Chem 47: 2826-32 (2004) Article DOI: 10.1021/jm030386z BindingDB Entry DOI: 10.7270/Q2XS5W4C
					More data for this Ligand-Target Pair
Stromelysin-1 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description In vitro inhibitory activity against recombinant matrix metalloprotease-3 was determined				J Med Chem 47: 2826-32 (2004) Article DOI: 10.1021/jm030386z BindingDB Entry DOI: 10.7270/Q2XS5W4C
					More data for this Ligand-Target Pair
Neutrophil collagenase (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description In vitro inhibitory activity against recombinant matrix metalloprotease-8 was determined				J Med Chem 47: 2826-32 (2004) Article DOI: 10.1021/jm030386z BindingDB Entry DOI: 10.7270/Q2XS5W4C
					More data for this Ligand-Target Pair
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description In vitro inhibitory activity against recombinant matrix metalloprotease-9 was determined				J Med Chem 47: 2826-32 (2004) Article DOI: 10.1021/jm030386z BindingDB Entry DOI: 10.7270/Q2XS5W4C
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description Inhibition of MMP2				J Med Chem 55: 7875-82 (2012) Article DOI: 10.1021/jm300981b BindingDB Entry DOI: 10.7270/Q23T9JBB
					More data for this Ligand-Target Pair
Carbonic anhydrase 12 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.44E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description Inhibition of human Carbonic anhydrase 12-mediated CO2 hydration by stopped-flow method				J Med Chem 55: 7875-82 (2012) Article DOI: 10.1021/jm300981b BindingDB Entry DOI: 10.7270/Q23T9JBB
					More data for this Ligand-Target Pair
Carbonic anhydrase 9 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	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	n/a	n/a	8.59E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description Inhibition of human Carbonic anhydrase 9-mediated CO2 hydration by stopped-flow method				J Med Chem 55: 7875-82 (2012) Article DOI: 10.1021/jm300981b BindingDB Entry DOI: 10.7270/Q23T9JBB
					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.23E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description Inhibition of human Carbonic anhydrase 2-mediated CO2 hydration by stopped-flow method				J Med Chem 55: 7875-82 (2012) Article DOI: 10.1021/jm300981b BindingDB Entry DOI: 10.7270/Q23T9JBB
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	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	n/a	n/a	7.36E+3	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description Inhibition of human Carbonic anhydrase 1-mediated CO2 hydration by stopped-flow method				J Med Chem 55: 7875-82 (2012) Article DOI: 10.1021/jm300981b BindingDB Entry DOI: 10.7270/Q23T9JBB
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50146805 (CHEMBL97951 | [(cyclohexylmethyl)amino]carbonylpho...) Show SMILES OP(O)(=O)C(=O)NCC1CCCCC1 Show InChI InChI=1S/C8H16NO4P/c10-8(14(11,12)13)9-6-7-4-2-1-3-5-7/h7H,1-6H2,(H,9,10)(H2,11,12,13)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Hebrew University of Jerusalem Curated by ChEMBL					Assay Description In vitro inhibitory activity against recombinant matrix metalloprotease-1 was determined				J Med Chem 47: 2826-32 (2004) Article DOI: 10.1021/jm030386z BindingDB Entry DOI: 10.7270/Q2XS5W4C
					More data for this Ligand-Target Pair