Found 196 hits with Last Name = 'bazin' and Initial = 'm' 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 |
|---|
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50360473
(CHEMBL1934749)Show SMILES CCCCN(CC)c1nc(C)nc2n(c(CO)c(C)c12)-c1c(C)cc(C)cc1C |(51.18,-11.74,;52.51,-10.97,;53.85,-11.74,;55.18,-10.97,;56.51,-11.74,;57.85,-10.97,;57.85,-9.43,;56.51,-13.28,;55.18,-14.06,;55.18,-15.6,;53.85,-16.37,;56.51,-16.36,;57.85,-15.6,;59.31,-16.06,;60.21,-14.82,;61.75,-14.81,;62.51,-13.47,;59.3,-13.58,;59.77,-12.11,;57.84,-14.06,;59.79,-17.52,;61.3,-17.83,;62.32,-16.68,;61.78,-19.29,;60.76,-20.45,;61.24,-21.91,;59.25,-20.13,;58.77,-18.67,;57.26,-18.36,)| Show InChI InChI=1S/C24H34N4O/c1-8-10-11-27(9-2)23-21-18(6)20(14-29)28(24(21)26-19(7)25-23)22-16(4)12-15(3)13-17(22)5/h12-13,29H,8-11,14H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 6 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CRF1 receptor expressed in CHO cells by cAMP assay |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50360475
(CHEMBL1934751)Show SMILES CCCCN(CC)c1nc(C)nc2n(c(COC)c(C)c12)-c1c(C)cc(C)cc1C |(10.4,-24.1,;11.73,-23.33,;13.07,-24.1,;14.4,-23.33,;15.73,-24.1,;17.07,-23.33,;17.07,-21.79,;15.73,-25.64,;14.4,-26.41,;14.4,-27.95,;13.07,-28.73,;15.73,-28.72,;17.07,-27.95,;18.53,-28.41,;19.43,-27.17,;20.97,-27.16,;21.73,-25.82,;23.27,-25.81,;18.52,-25.93,;18.99,-24.46,;17.06,-26.41,;19.01,-29.87,;20.52,-30.18,;21.54,-29.03,;21.01,-31.64,;19.98,-32.8,;20.47,-34.26,;18.47,-32.48,;17.99,-31.02,;16.48,-30.71,)| Show InChI InChI=1S/C25H36N4O/c1-9-11-12-28(10-2)24-22-19(6)21(15-30-8)29(25(22)27-20(7)26-24)23-17(4)13-16(3)14-18(23)5/h13-14H,9-12,15H2,1-8H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 11 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CRF1 receptor expressed in CHO cells by cAMP assay |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50074501
(Butyl-ethyl-[2,5,6-trimethyl-7-(2,4,6-trimethyl-ph...)Show SMILES CCCCN(CC)c1nc(C)nc2n(c(C)c(C)c12)-c1c(C)cc(C)cc1C |(4.9,1.82,;3.57,2.56,;2.24,1.79,;.91,2.55,;-.44,1.78,;-1.76,2.55,;-3.1,1.78,;-.42,.25,;-1.75,-.52,;-1.75,-2.06,;-3.08,-2.83,;-.42,-2.83,;.91,-2.06,;2.38,-2.54,;3.31,-1.29,;4.85,-1.29,;2.38,-.03,;2.86,1.43,;.91,-.52,;2.86,-4.02,;4.37,-4.33,;5.39,-3.17,;4.85,-5.78,;3.82,-6.93,;4.31,-8.4,;2.32,-6.61,;1.84,-5.14,;.33,-4.82,)| Show InChI InChI=1S/C24H34N4/c1-9-11-12-27(10-2)23-21-18(6)19(7)28(24(21)26-20(8)25-23)22-16(4)13-15(3)14-17(22)5/h13-14H,9-12H2,1-8H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| Purchase
CHEMBL
MCE
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| 32 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CRF1 receptor expressed in CHO cells by cAMP assay |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Corticotropin-releasing factor receptor 1
(Homo sapiens (Human)) | BDBM50360474
(CHEMBL1934750)Show SMILES CCCCN(CC)c1nc(C)nc2n(c(C=O)c(C)c12)-c1c(C)cc(C)cc1C |(-9.11,-24.17,;-7.77,-23.4,;-6.44,-24.17,;-5.11,-23.4,;-3.77,-24.17,;-2.44,-23.4,;-2.44,-21.86,;-3.77,-25.71,;-5.1,-26.48,;-5.1,-28.02,;-6.43,-28.8,;-3.77,-28.79,;-2.44,-28.02,;-.97,-28.48,;-.08,-27.24,;1.46,-27.23,;2.22,-25.89,;-.99,-26,;-.52,-24.53,;-2.44,-26.48,;-.49,-29.94,;1.01,-30.25,;2.03,-29.1,;1.5,-31.71,;.47,-32.87,;.96,-34.33,;-1.04,-32.55,;-1.52,-31.09,;-3.03,-30.78,)| Show InChI InChI=1S/C24H32N4O/c1-8-10-11-27(9-2)23-21-18(6)20(14-29)28(24(21)26-19(7)25-23)22-16(4)12-15(3)13-17(22)5/h12-14H,8-11H2,1-7H3 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 52 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at human recombinant CRF1 receptor expressed in CHO cells by cAMP assay |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM18627
((10S,11S,14S,15S,17R)-17-[4-(dimethylamino)phenyl]...)Show SMILES [H][C@@]12CC[C@@](O)(C#CC)[C@@]1(C)C[C@@H](C1=C3CCC(=O)C=C3CC[C@@]21[H])c1ccc(cc1)N(C)C |r,c:14,20| Show InChI InChI=1S/C29H35NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17,24-26,32H,8,11-14,16,18H2,1-4H3/t24-,25+,26-,28-,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
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antibodypedia
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| Purchase
DrugBank
MCE
KEGG
MMDB
PC cid
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PDB
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Patents
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| DrugBank
PDB
Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at progesterone receptor |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Progesterone receptor
(Homo sapiens (Human)) | BDBM50360470
(CHEMBL1934746)Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C=O |r,c:18,t:11| Show InChI InChI=1S/C29H33NO3/c1-4-14-29(33)15-13-26-24-11-7-20-16-22(32)10-12-23(20)27(24)25(17-28(26,29)2)19-5-8-21(9-6-19)30(3)18-31/h5-6,8-9,16,18,24-26,33H,7,10-13,15,17H2,1-3H3/t24-,25+,26-,28-,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at progesterone receptor |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50568546
(CHEMBL4853288) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 35 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374929
(CHEMBL402364)Show SMILES O=C1NC(=O)\C(=C\c2c[nH]c3ccccc23)C(=O)N1c1cccc2ccccc12 Show InChI InChI=1S/C23H15N3O3/c27-21-18(12-15-13-24-19-10-4-3-8-16(15)19)22(28)26(23(29)25-21)20-11-5-7-14-6-1-2-9-17(14)20/h1-13,24H,(H,25,27,29)/b18-12- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 60 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50568545
(CHEMBL4877608)Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568544
(CHEMBL4870529)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccnc(N)n1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 160 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374925
(CHEMBL272367)Show SMILES Cn1cc(\C=C2\C(=O)NC(=O)N(C2=O)c2cccc3ccccc23)c2ccccc12 Show InChI InChI=1S/C24H17N3O3/c1-26-14-16(18-10-4-5-11-20(18)26)13-19-22(28)25-24(30)27(23(19)29)21-12-6-8-15-7-2-3-9-17(15)21/h2-14H,1H3,(H,25,28,30)/b19-13- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568545
(CHEMBL4877608)Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 180 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568546
(CHEMBL4853288) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 200 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81848
(Bipiperidinyl carboxylic acid amide, 20)Show SMILES CCCCOc1ccc(NC(=O)N2CCC(CC2)N2CCCC(C2)C(=O)N2CCN(CC2)c2cccc(C)n2)cc1 Show InChI InChI=1S/C32H46N6O3/c1-3-4-23-41-29-12-10-27(11-13-29)34-32(40)37-17-14-28(15-18-37)38-16-6-8-26(24-38)31(39)36-21-19-35(20-22-36)30-9-5-7-25(2)33-30/h5,7,9-13,26,28H,3-4,6,8,14-24H2,1-2H3,(H,34,40) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| 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 |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
Cyclin-T1/Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50256734
((-)-Cercosporamide | CHEMBL475816)Show SMILES CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6| Show InChI InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,10,19,21H,1-2H3,(H2,17,23)/t10?,16-/m1/s1 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 220 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human CDK9/CyclinT using Ulight-CFFKNIVTPRTPPPSQGK-amide as substrate after 90 mins by LANCE assay |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50568544
(CHEMBL4870529)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccnc(N)n1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 250 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374930
(CHEMBL257458)Show SMILES O=C1NC(=O)\C(=C\c2c[nH]c3ccccc23)C(=O)N1c1ccccc1-c1ccccc1 Show InChI InChI=1S/C25H17N3O3/c29-23-20(14-17-15-26-21-12-6-4-10-18(17)21)24(30)28(25(31)27-23)22-13-7-5-11-19(22)16-8-2-1-3-9-16/h1-15,26H,(H,27,29,31)/b20-14- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 260 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Protein kinase C beta type
(Homo sapiens (Human)) | BDBM50256734
((-)-Cercosporamide | CHEMBL475816)Show SMILES CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6| Show InChI InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,10,19,21H,1-2H3,(H2,17,23)/t10?,16-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 300 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of human PKCbeta |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM50360471
(CHEMBL1934747)Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3C(=C[C@]12C)c1ccc(cc1)N(C)C |r,c:18,21,t:11| Show InChI InChI=1S/C29H33NO2/c1-5-15-29(32)16-14-26-24-12-8-20-17-22(31)11-13-23(20)27(24)25(18-28(26,29)2)19-6-9-21(10-7-19)30(3)4/h6-7,9-10,17-18,24,26,32H,8,11-14,16H2,1-4H3/t24-,26-,28-,29-/m0/s1 | PDB
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| CHEMBL
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PC sid
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| Article
PubMed
| n/a | n/a | 307 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at progesterone receptor |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM50360469
(CHEMBL1934745)Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC(=O)C(CCC(O)=O)=C3[C@H](C[C@]12C)c1ccc(cc1)N(C)C=O |r,c:18| Show InChI InChI=1S/C28H33NO5/c1-4-14-28(34)15-13-23-20-9-11-24(31)21(10-12-25(32)33)26(20)22(16-27(23,28)2)18-5-7-19(8-6-18)29(3)17-30/h5-8,17,20,22-23,34H,9-13,15-16H2,1-3H3,(H,32,33)/t20-,22+,23-,27-,28-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 430 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at progesterone receptor |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Cyclin-T1/Cyclin-dependent kinase 9
(Homo sapiens (Human)) | BDBM50568546
(CHEMBL4853288) | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 500 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human recombinant CDK9/CyclinT expressed in baculovirus infected Sf9 cells using YSPTSPSYSPTSPSYSPTSPSKKK as substrate in presence of [... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50568541
(CHEMBL4860872)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccccc1)-c1ccnc(N)n1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 590 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50256734
((-)-Cercosporamide | CHEMBL475816)Show SMILES CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6| Show InChI InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,10,19,21H,1-2H3,(H2,17,23)/t10?,16-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 770 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human CDK2/Cyclin A using ATP and Ulight-CFFKNIVTPRTPPPSQGK-amide as substrate after 30 mins by LANCE assay |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Progesterone receptor
(Homo sapiens (Human)) | BDBM50360472
(CHEMBL1934748)Show SMILES CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@](Cl)(C[C@]12C)c1cc(Cl)c(N(C)C)c(Cl)c1 |r,c:18,t:11| Show InChI InChI=1S/C29H32Cl3NO2/c1-5-11-28(35)12-10-22-21-8-6-17-13-19(34)7-9-20(17)25(21)29(32,16-27(22,28)2)18-14-23(30)26(33(3)4)24(31)15-18/h13-15,21-22,35H,6-10,12,16H2,1-4H3/t21-,22-,27-,28-,29-/m0/s1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 771 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer Inc.
Curated by ChEMBL
| Assay Description
Antagonist activity at progesterone receptor |
Bioorg Med Chem Lett 22: 723-8 (2011)
Article DOI: 10.1016/j.bmcl.2011.10.066
BindingDB Entry DOI: 10.7270/Q2J67HCF |
More data for this
Ligand-Target Pair | |
Cyclin-A2/Cyclin-dependent kinase 2
(Homo sapiens (Human)) | BDBM50568546
(CHEMBL4853288) | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 800 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human CDK2/ cyclinA using histone H1 as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374933
(CHEMBL402647)Show SMILES O=C1NC(=O)\C(=C\c2c[nH]c3ccccc23)C(=O)N1c1ccccc1 Show InChI InChI=1S/C19H13N3O3/c23-17-15(10-12-11-20-16-9-5-4-8-14(12)16)18(24)22(19(25)21-17)13-6-2-1-3-7-13/h1-11,20H,(H,21,23,25)/b15-10- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 900 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50568540
(CHEMBL4872681)Show SMILES CSc1nccc(n1)-c1c(nc2c(nccn12)N(C)C)-c1ccccc1 | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 900 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant mouse CLK1 expressed in bacteria using GRSRSRSRSRSR as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568538
(CHEMBL3634367)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccncc1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 920 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Protein kinase C alpha type
(Homo sapiens (Human)) | BDBM50256734
((-)-Cercosporamide | CHEMBL475816)Show SMILES CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6| Show InChI InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,10,19,21H,1-2H3,(H2,17,23)/t10?,16-/m1/s1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 1.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of human PKCalpha |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374928
(CHEMBL404714)Show SMILES Clc1ccc(cc1)N1C(=O)NC(=O)\C(=C\c2ccccc2)C1=O Show InChI InChI=1S/C17H11ClN2O3/c18-12-6-8-13(9-7-12)20-16(22)14(15(21)19-17(20)23)10-11-4-2-1-3-5-11/h1-10H,(H,19,21,23)/b14-10- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
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| Purchase
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 |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Cyclin-dependent kinase 5 activator 1
(Homo sapiens (Human)) | BDBM50568545
(CHEMBL4877608)Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1 | PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| 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 human recombinant CDK5/ p25 expressed in bacterial expression system using histone H1 as substrate in presence of [gamma-33P]ATP by rad... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568541
(CHEMBL4860872)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccccc1)-c1ccnc(N)n1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.05E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Glycogen synthase kinase-3 beta/[Tau protein] kinase
(Sus scrofa) | BDBM50568546
(CHEMBL4853288) | PDB
UniProtKB/TrEMBL
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of pig brain GSK alpha/beta using YRRAAVPPSPSLSRHSSPHQSpEDEEE as substrate in presence of [gamma-33P]ATP by radiometric assay |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase pim-1
(Homo sapiens (Human)) | BDBM50274761
(CHEMBL4127885)Show InChI InChI=1S/C11H8N4O4/c12-10-9-7(14-2-15-10)5-3(16)1-4(17)6(11(13)18)8(5)19-9/h1-2,16-17H,(H2,13,18)(H2,12,14,15) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.29E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of recombinant human PIM1 using CREBtide as substrate after 60 mins by LANCE assay |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374935
(CHEMBL271052)Show InChI InChI=1S/C15H10N2O4/c18-13-12(9-11-7-4-8-21-11)14(19)17(15(20)16-13)10-5-2-1-3-6-10/h1-9H,(H,16,18,20)/b12-9- | PDB
UniProtKB/SwissProt
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DrugBank
antibodypedia
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374927
(CHEMBL255836)Show SMILES FC(F)(F)c1ccc(\C=C2\C(=O)NC(=O)N(C2=O)c2ccccc2)cc1 Show InChI InChI=1S/C18H11F3N2O3/c19-18(20,21)12-8-6-11(7-9-12)10-14-15(24)22-17(26)23(16(14)25)13-4-2-1-3-5-13/h1-10H,(H,22,24,26)/b14-10- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
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| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374926
(CHEMBL272366)Show SMILES Clc1cc(Cl)cc(c1)N1C(=O)NC(=O)\C(=C\c2ccccc2)C1=O Show InChI InChI=1S/C17H10Cl2N2O3/c18-11-7-12(19)9-13(8-11)21-16(23)14(15(22)20-17(21)24)6-10-4-2-1-3-5-10/h1-9H,(H,20,22,24)/b14-6- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 1.60E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Dual specificity tyrosine-phosphorylation-regulated kinase 1A
(RAT) | BDBM50568545
(CHEMBL4877608)Show SMILES CSc1nccc(n1)-c1c(nc2c(N)nccn12)-c1ccc(F)cc1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant rat DYRK1A (1 to 499 ) expressed in bacterial expression system using KKISGRLSPIMTEQ as substrate in presence of [gamma-33P... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568536
(CHEMBL4866187)Show SMILES CN(C)c1nccn2c(c(nc12)-c1ccc(F)cc1)-c1ccc2[nH]ncc2c1 | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.08E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374923
(CHEMBL255561)Show InChI InChI=1S/C17H12N2O3/c20-15-14(11-12-7-3-1-4-8-12)16(21)19(17(22)18-15)13-9-5-2-6-10-13/h1-11H,(H,18,20,22)/b14-11- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
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AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.20E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81834
(Bipiperidinyl carboxylic acid amide, 7)Show SMILES CC(C)(C)NC(=O)N1CCC(CC1)N1CCCC(C1)C(=O)N1CCN(CC1)c1ccccc1Cl Show InChI InChI=1S/C26H40ClN5O2/c1-26(2,3)28-25(34)31-13-10-21(11-14-31)32-12-6-7-20(19-32)24(33)30-17-15-29(16-18-30)23-9-5-4-8-22(23)27/h4-5,8-9,20-21H,6-7,10-19H2,1-3H3,(H,28,34) | UniProtKB/SwissProt
antibodypedia
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| PC cid
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UniChem
| Article
PubMed
| n/a | n/a | 2.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
Aurora kinase B
(Homo sapiens (Human)) | BDBM50256734
((-)-Cercosporamide | CHEMBL475816)Show SMILES CC(=O)C1C(=O)C=C2Oc3c(c(O)cc(O)c3C(N)=O)[C@]2(C)C1=O |r,t:6| Show InChI InChI=1S/C16H13NO7/c1-5(18)10-7(20)4-9-16(2,14(10)22)12-8(21)3-6(19)11(15(17)23)13(12)24-9/h3-4,10,19,21H,1-2H3,(H2,17,23)/t10?,16-/m1/s1 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Patents
Similars
| Article
PubMed
| n/a | n/a | 2.40E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of human Aurora-B using full-length histone H3 as substrate after 10 mins |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81830
(Bipiperidinyl carboxylic acid amide, 3)Show SMILES COc1ccc(NC(=O)N2CCC(CC2)N2CCCC(C2)C(=O)N2CCN(CC2)c2ccccc2Cl)c(C)c1 Show InChI InChI=1S/C30H40ClN5O3/c1-22-20-25(39-2)9-10-27(22)32-30(38)35-14-11-24(12-15-35)36-13-5-6-23(21-36)29(37)34-18-16-33(17-19-34)28-8-4-3-7-26(28)31/h3-4,7-10,20,23-24H,5-6,11-19,21H2,1-2H3,(H,32,38) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
Dual specificity protein kinase CLK1
(Mus musculus) | BDBM50274761
(CHEMBL4127885)Show InChI InChI=1S/C11H8N4O4/c12-10-9-7(14-2-15-10)5-3(16)1-4(17)6(11(13)18)8(5)19-9/h1-2,16-17H,(H2,13,18)(H2,12,14,15) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 2.69E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ de Nantes
Curated by ChEMBL
| Assay Description
Inhibition of mouse CLK1 using Ulight-CFFKNIVTPRTPPPSQGK-amide as substrate after 30 mins by LANCE assay |
Bioorg Med Chem Lett 28: 2250-2255 (2018)
Article DOI: 10.1016/j.bmcl.2018.05.044
BindingDB Entry DOI: 10.7270/Q2G44SSP |
More data for this
Ligand-Target Pair | |
Casein kinase I isoform epsilon
(Homo sapiens (Human)) | BDBM50568539
(CHEMBL4875029) | PDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.90E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human CK1 epsilon expressed in baculovirus infected Sf9 cells using RRKHAAIGSpAYSITA as substrate |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81837
(Bipiperidinyl carboxylic acid amide, 1)Show SMILES CCCCOC(=O)NC(=O)N1CCC(CC1)N1CCCC(C1)C(=O)N1CCN(CC1)c1ccccc1C Show InChI InChI=1S/C28H43N5O4/c1-3-4-20-37-28(36)29-27(35)32-14-11-24(12-15-32)33-13-7-9-23(21-33)26(34)31-18-16-30(17-19-31)25-10-6-5-8-22(25)2/h5-6,8,10,23-24H,3-4,7,9,11-21H2,1-2H3,(H,29,35,36) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81836
(Bipiperidinyl carboxylic acid amide, 9)Show SMILES CCCCOC(=O)NC(=O)N1CCC(CC1)N1CCCC(C1)C(=O)N1CCN(CC1)c1cccc(C)n1 Show InChI InChI=1S/C27H42N6O4/c1-3-4-19-37-27(36)29-26(35)32-13-10-23(11-14-32)33-12-6-8-22(20-33)25(34)31-17-15-30(16-18-31)24-9-5-7-21(2)28-24/h5,7,9,22-23H,3-4,6,8,10-20H2,1-2H3,(H,29,35,36) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
C-C chemokine receptor type 4
(Homo sapiens (Human)) | BDBM81832
(Bipiperidinyl carboxylic acid amide, 6)Show SMILES Cc1ccccc1N1CCN(CC1)C(=O)C1CCCN(C1)C1CCN(CC1)C(=O)NC(C)(C)C Show InChI InChI=1S/C27H43N5O2/c1-21-8-5-6-10-24(21)29-16-18-30(19-17-29)25(33)22-9-7-13-32(20-22)23-11-14-31(15-12-23)26(34)28-27(2,3)4/h5-6,8,10,22-23H,7,9,11-20H2,1-4H3,(H,28,34) | UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 3.70E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Pfizer
| Assay Description
Cell-based assay for CCR4 was developed to screen small-molecule compound library using a Fluorometric Imaging Plate Reader (FlIPR) assay to identify... |
Chem Biol Drug Des 70: 268-72 (2007)
Article DOI: 10.1111/j.1747-0285.2007.00551.x
BindingDB Entry DOI: 10.7270/Q2K35S44 |
More data for this
Ligand-Target Pair | |
Integrin alpha-4/beta-7
(Homo sapiens (Human)) | BDBM50374934
(CHEMBL271051)Show SMILES Cn1cc(\C=C2\C(=O)NC(=O)N(C2=O)c2ccccc2)c2ccccc12 Show InChI InChI=1S/C20H15N3O3/c1-22-12-13(15-9-5-6-10-17(15)22)11-16-18(24)21-20(26)23(19(16)25)14-7-3-2-4-8-14/h2-12H,1H3,(H,21,24,26)/b16-11- | PDB
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
antibodypedia
GoogleScholar
AffyNet
| Purchase
CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 4.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Millennium Pharmaceuticals
Curated by ChEMBL
| Assay Description
Inhibition of human integrin alpha-4-beta-7-MAdCAM interaction in human RPMI 8866 cells by whole-cell adhesion assay |
Bioorg Med Chem Lett 18: 2509-12 (2008)
Article DOI: 10.1016/j.bmcl.2007.07.068
BindingDB Entry DOI: 10.7270/Q2N58N8Q |
More data for this
Ligand-Target Pair | |
Serine/threonine-protein kinase haspin
(Homo sapiens (Human)) | BDBM50568546
(CHEMBL4853288) | PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 4.50E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of recombinant human HASPIN (470 to 798 residues) expressed in bacterial expression system using ARTKQTARKSTGGKAPRKQLA as substrate in pre... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112956
BindingDB Entry DOI: 10.7270/Q2125XD2 |
More data for this
Ligand-Target Pair | |
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