Found 16 hits Enz. Inhib. hit(s) with Target = 'Calcium release-activated calcium channel protein/Stromal interaction molecule 1' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50575331
(CHEMBL4868242)Show SMILES Cc1c(cccc1-c1ccc(NC(=O)c2c(F)cccc2F)cc1)-c1nn(C)c(=O)o1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 76 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of Orai1/STIM1 (unknown origin) expressed in HEK293 cells assessed as reduction in Ca2+-release activated Ca2+ entry current by manual pat... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c01403
BindingDB Entry DOI: 10.7270/Q2C82F4Q |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50575336
(CHEMBL4753998)Show SMILES Cc1cccc(F)c1C(=O)Nc1cnc(cn1)-c1cc2OC(F)(F)Oc2cc1Cl | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 119 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of Orai1/STIM1 (unknown origin) |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c01403
BindingDB Entry DOI: 10.7270/Q2C82F4Q |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549365
(CHEMBL3403742) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 228 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549358
(CHEMBL4753023)Show SMILES COc1ccc(F)c(c1)-c1ccc(cc1)-n1cc(nn1)-c1cccc(c1)C(O)=O | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 361 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Rattus norvegicus) | BDBM50204544
(CHEMBL262766)Show SMILES Cc1nnsc1C(=O)Nc1ccc(cc1)-n1nc(cc1C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C15H9F6N5OS/c1-7-12(28-25-23-7)13(27)22-8-2-4-9(5-3-8)26-11(15(19,20)21)6-10(24-26)14(16,17)18/h2-6H,1H3,(H,22,27) | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Nebraska Medical Center
Curated by ChEMBL
| Assay Description
Inhibition of ORAI/STIM1 in thapsigargin treated rat RBL2H3 cells assessed as reduction in store-operated calcium entry after 5 mins by fura-2-AM dye... |
J Med Chem 62: 7589-7602 (2019)
Article DOI: 10.1021/acs.jmedchem.8b01954
BindingDB Entry DOI: 10.7270/Q2XS5ZR8 |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549357
(CHEMBL4794288)Show SMILES COc1cccc(-c2ccc(cc2)-c2cn(nn2)-c2cccc(c2)C(O)=O)c1OC | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 781 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549360
(CHEMBL4780000)Show SMILES COc1cc(OC)cc(c1)-c1ccc(cc1)-n1cc(nn1)-c1cccc(c1)C(O)=O | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 802 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549363
(CHEMBL4751678)Show SMILES COc1cccc(c1)-c1ccc(cc1)-n1cc(nn1)-c1cccc(c1)C(O)=O | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 807 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549362
(CHEMBL4761656)Show SMILES COc1cccc(-c2ccc(cc2)-n2cc(nn2)-c2cccc(c2)C(O)=O)c1OC | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 851 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549356
(CHEMBL4799904)Show SMILES COc1ccc(F)c(c1)-c1ccc(cc1)-c1cn(nn1)-c1cccc(c1)C(O)=O | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 866 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50575334
(CHEMBL4863881)Show SMILES Fc1cccc(c1Cn1ccc(NC(=O)c2c(F)cccc2F)n1)C(F)(F)F | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of Orai1/STIM1 (unknown origin) expressed in HEK293 cells assessed as reduction in Ca2+-release activated Ca2+ entry current by manual pat... |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c01403
BindingDB Entry DOI: 10.7270/Q2C82F4Q |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549359
(CHEMBL4750981)Show SMILES OC(=O)c1cccc(c1)-c1cn(nn1)-c1ccc(cc1)-c1ccc2OCCOc2c1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549361
(CHEMBL4742227)Show SMILES OC(=O)c1cccc(c1)-c1cn(nn1)-c1ccc(cc1)-c1cccc2OCCOc12 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.62E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50549364
(CHEMBL4742960)Show SMILES COc1ccc(OC)c(c1)-c1ccc(cc1)-c1cn(nn1)-c1cccc(c1)C(O)=O | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.79E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50575335
(CHEMBL4570175)Show SMILES Oc1ccc(Cn2ccc(NC(=O)c3c(F)cccc3F)n2)c(c1)C(F)(F)F | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human STIM1/Orai1 expressed in HEK293 cells assessed as reduction in Orai1 current by electrophysiological method |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.1c01403
BindingDB Entry DOI: 10.7270/Q2C82F4Q |
More data for this
Ligand-Target Pair | |
Calcium release-activated calcium channel protein/Stromal interaction molecule 1
(Homo sapiens (Human)) | BDBM50018011
(Aubagio | CHEBI:68540 | HMR-1726 | TERIFLUNOMIDE)Show InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7- | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
GoogleScholar
AffyNet
| Purchase
MCE
PC cid
PC sid
PDB
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of STIM1/Orai1 (unknown origin) expressed in HEK293 cells assessed as reduction in tBHQ-induced calcium response |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c01305
BindingDB Entry DOI: 10.7270/Q2HH6PPZ |
More data for this
Ligand-Target Pair | |
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