Found 6 hits for monomerid = 50428423 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 12
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 1.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 12 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 9
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 3.27E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 9 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 13 (CA XIII)
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 4.24E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 13 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6.55E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 1 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 7.84E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 7 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM50428423
(CHEMBL2334357)Show SMILES COc1ccc(cc1O)-c1c2-c3cc(OC)c(OS([O-])(=O)=O)cc3CCn2c2c1c1cc(O)c(OC)cc1oc2=O Show InChI InChI=1S/C28H23NO11S/c1-36-19-5-4-14(8-17(19)30)24-25-16-10-18(31)21(37-2)12-20(16)39-28(32)27(25)29-7-6-13-9-23(40-41(33,34)35)22(38-3)11-15(13)26(24)29/h4-5,8-12,30-31H,6-7H2,1-3H3,(H,33,34,35)/p-1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
KEGG
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| >1.00E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Griffith University
Curated by ChEMBL
| Assay Description
Inhibition of human carbonic anhydrase 2 preincubated for 6 hrs by CO2 hydration stopped-flow assay |
Bioorg Med Chem 21: 1539-43 (2013)
Article DOI: 10.1016/j.bmc.2012.07.021
BindingDB Entry DOI: 10.7270/Q2S75HNS |
More data for this
Ligand-Target Pair | |
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