Found 45 hits Enz. Inhib. hit(s) with Target = 'Coiled-coil domain-containing protein 6' 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 |
|---|
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50382959
(CEP-32496 | CHEMBL2029988 | US9730937, Example 261)Show SMILES COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC Show InChI InChI=1S/C24H22F3N5O5/c1-23(2,24(25,26)27)19-11-20(32-37-19)31-22(33)30-13-6-5-7-14(8-13)36-21-15-9-17(34-3)18(35-4)10-16(15)28-12-29-21/h5-12H,1-4H3,(H2,30,31,32,33) | UniProtKB/SwissProt
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| Article
PubMed
| n/a | n/a | 0.330 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c02167
BindingDB Entry DOI: 10.7270/Q22R3WQ4 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625349
(US20230322769, Compound 58 | US20230322769, Compou...)Show SMILES COc1ccc(CN2CCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn3CCCc23)cn1 | PDB
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| PC cid
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UniChem
| | n/a | n/a | 0.340 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50601766
(CHEMBL5171764)Show SMILES COC1(CCC(CC1)c1nc(C)cc(Nc2cc(C)[nH]n2)n1)C(=O)N[C@@H](C)c1ccc(nc1)-n1cc(F)cn1 |r| | UniProtKB/SwissProt
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PubMed
| n/a | n/a | 0.400 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c02167
BindingDB Entry DOI: 10.7270/Q22R3WQ4 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625352
(US20230322769, Compound 65)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCOCC2)cn1 | PDB
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| MCE
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UniChem
| | n/a | n/a | 0.520 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50514844
(CHEMBL4473213)Show SMILES CC(C)(C)c1cc(NC(=O)Cc2ccc(cc2)-n2cnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)no1 Show InChI InChI=1S/C29H28N4O4S/c1-29(2,3)26-17-27(32-37-26)31-28(34)15-19-5-10-22(11-6-19)33-18-30-24-16-21(9-14-25(24)33)20-7-12-23(13-8-20)38(4,35)36/h5-14,16-18H,15H2,1-4H3,(H,31,32,34) | UniProtKB/SwissProt
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| PC cid
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UniChem
| Article
PubMed
| n/a | n/a | 0.670 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Napoli "Federico II"
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET in human TPC1 cells assessed as reduction in cell proliferation supplemented with fresh medium containing compound for every ... |
J Med Chem 63: 4506-4516 (2020)
Article DOI: 10.1021/acs.jmedchem.9b01336
BindingDB Entry DOI: 10.7270/Q2154MD0 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50514844
(CHEMBL4473213)Show SMILES CC(C)(C)c1cc(NC(=O)Cc2ccc(cc2)-n2cnc3cc(ccc23)-c2ccc(cc2)S(C)(=O)=O)no1 Show InChI InChI=1S/C29H28N4O4S/c1-29(2,3)26-17-27(32-37-26)31-28(34)15-19-5-10-22(11-6-19)33-18-30-24-16-21(9-14-25(24)33)20-7-12-23(13-8-20)38(4,35)36/h5-14,16-18H,15H2,1-4H3,(H,31,32,34) | UniProtKB/SwissProt
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| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 0.670 | n/a | n/a | n/a | n/a | n/a | n/a |
Universit£ di Napoli "Federico II"
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET in human LC2/ad cells assessed as reduction in cell proliferation supplemented with fresh medium containing compound for ever... |
J Med Chem 63: 4506-4516 (2020)
Article DOI: 10.1021/acs.jmedchem.9b01336
BindingDB Entry DOI: 10.7270/Q2154MD0 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625351
(US20230322769, Compound 64 | US20230322769, Compou...)Show SMILES COc1ccc(CN2CCCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
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| PC cid
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| | n/a | n/a | 1.02 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625348
(US20230322769, Compound 57 | US20230322769, Compou...)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
UniProtKB/SwissProt
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| PC cid
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UniChem
| | n/a | n/a | 1.13 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM296429
(US10112942, Example 163 | US10112942, Example 166 ...)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(OCC(C)(C)O)cn3ncc(C#N)c23)cn1 Show InChI InChI=1S/C29H31N7O3/c1-29(2,37)18-39-24-9-25(28-21(10-30)13-33-36(28)17-24)20-5-6-26(31-12-20)34-15-22-8-23(16-34)35(22)14-19-4-7-27(38-3)32-11-19/h4-7,9,11-13,17,22-23,37H,8,14-16,18H2,1-3H3 | PDB
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| n/a | n/a | 2.07 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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More data for this
Ligand-Target Pair | 
3D Structure (crystal) |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625338
(US20230322769, Compound 20)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCP(C)(=O)CC2)cn1 | PDB
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| PC cid
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| | n/a | n/a | 2.14 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625346
(US20230322769, Compound 51)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn3CCCc23)cn1 | PDB
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| PC cid
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| | n/a | n/a | 2.15 | n/a | n/a | n/a | n/a | n/a | n/a |
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Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM2579
((2S,3R,4R,6R)-3-methoxy-2-methyl-4-(methylamino)-2...)Show SMILES CN[C@@H]1C[C@H]2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13 |r| Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20-,26-,28+/m1/s1 | UniProtKB/SwissProt
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| Article
PubMed
| n/a | n/a | 2.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human N-terminal GST-HIS6 fused CCDC6-RET fusion protein (Met1 to Ser503 residues) expressed in Sf9 insect cells using TRK-C-derived pe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112755
BindingDB Entry DOI: 10.7270/Q2J96B20 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625350
(US20230322769, Compound 60 | US20230322769, Compou...)Show SMILES COc1ccc(cn1)C(=O)N1CCN(CC1)c1ccc(cn1)-c1cc(cn2ncc(C#N)c12)-c1cc2CCCn2n1 | PDB
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| PC cid
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| | n/a | n/a | 2.54 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625337
(US20230322769, Compound 17)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CC3CC(C2)N3C)cn1 | PDB
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| PC cid
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| | n/a | n/a | 2.61 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625367
(US20230322769, Compound 87 | US20230322769, Compou...)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCN(C)CC2)cn1 | PDB
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| MCE
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| | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625369
(US20230322769, Compound 89)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CCN(C)C(=O)C2)cn1 | PDB
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antibodypedia
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| PC cid
PC sid
UniChem
| | n/a | n/a | 3.04 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625342
(US20230322769, Compound 32)Show SMILES COc1ccc(CN2CCCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn(C)c2)cn1 | PDB
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| PC cid
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| | n/a | n/a | 3.13 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625335
(US20230322769, Compound 16)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)N2CC3CC(C2)N3)cn1 | PDB
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| PC cid
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UniChem
| | n/a | n/a | 3.65 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625348
(US20230322769, Compound 57 | US20230322769, Compou...)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
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| PC cid
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UniChem
| | n/a | n/a | 4.44 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625358
(US20230322769, Compound 78)Show SMILES COc1ccc(CN2C3CC2CN(C3)c2ccc(cn2)-c2cc(NCC(C)(C)O)cn3ncc(C#N)c23)cn1 | PDB
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| | n/a | n/a | 4.60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538514
(CHEMBL4644274)Show SMILES COc1ccc(cc1OC)-c1cnn2c(N)c(c(NC3CC(C)(C)N(C)C(C)(C)C3)nc12)-c1ccccc1 Show InChI InChI=1S/C30H38N6O2/c1-29(2)16-21(17-30(3,4)35(29)5)33-27-25(19-11-9-8-10-12-19)26(31)36-28(34-27)22(18-32-36)20-13-14-23(37-6)24(15-20)38-7/h8-15,18,21H,16-17,31H2,1-7H3,(H,33,34) | UniProtKB/SwissProt
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| n/a | n/a | 5.30 | n/a | n/a | n/a | n/a | n/a | n/a |
The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50556136
(CHEMBL4790634)Show SMILES CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(Oc4nc(nc5[nH]ncc45)-c4cccnc4)c3)cc2C(F)(F)F)CC1 | UniProtKB/SwissProt
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| n/a | n/a | 5.40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
Inhibition of human N-terminal GST-HIS6 fused CCDC6-RET fusion protein (Met1 to Ser503 residues) expressed in Sf9 insect cells using TRK-C-derived pe... |
Citation and Details
Article DOI: 10.1016/j.ejmech.2020.112755
BindingDB Entry DOI: 10.7270/Q2J96B20 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625350
(US20230322769, Compound 60 | US20230322769, Compou...)Show SMILES COc1ccc(cn1)C(=O)N1CCN(CC1)c1ccc(cn1)-c1cc(cn2ncc(C#N)c12)-c1cc2CCCn2n1 | PDB
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| | n/a | n/a | 6.01 | n/a | n/a | n/a | n/a | n/a | n/a |
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538517
(CHEMBL4639022)Show SMILES CN1C(C)(C)CC(CC1(C)C)Nc1nc2c(cnn2c(N)c1-c1ccccc1)-c1ccc(cc1)C(=O)N1CCN(CC1)S(C)(=O)=O Show InChI InChI=1S/C34H44N8O3S/c1-33(2)20-26(21-34(3,4)39(33)5)37-30-28(24-10-8-7-9-11-24)29(35)42-31(38-30)27(22-36-42)23-12-14-25(15-13-23)32(43)40-16-18-41(19-17-40)46(6,44)45/h7-15,22,26H,16-21,35H2,1-6H3,(H,37,38) | UniProtKB/SwissProt
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| n/a | n/a | 6.20 | n/a | n/a | n/a | n/a | n/a | n/a |
The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50382959
(CEP-32496 | CHEMBL2029988 | US9730937, Example 261)Show SMILES COc1cc2ncnc(Oc3cccc(NC(=O)Nc4cc(on4)C(C)(C)C(F)(F)F)c3)c2cc1OC Show InChI InChI=1S/C24H22F3N5O5/c1-23(2,24(25,26)27)19-11-20(32-37-19)31-22(33)30-13-6-5-7-14(8-13)36-21-15-9-17(34-3)18(35-4)10-16(15)28-12-29-21/h5-12H,1-4H3,(H2,30,31,32,33) | UniProtKB/SwissProt
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| n/a | n/a | 7 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c02167
BindingDB Entry DOI: 10.7270/Q22R3WQ4 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625347
(US20230322769, Compound 55)Show SMILES COc1ccc(CN2CCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
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| PC cid
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UniChem
| | n/a | n/a | 7.45 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625349
(US20230322769, Compound 58 | US20230322769, Compou...)Show SMILES COc1ccc(CN2CCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn3CCCc23)cn1 | PDB
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UniChem
| | n/a | n/a | 8.07 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625351
(US20230322769, Compound 64 | US20230322769, Compou...)Show SMILES COc1ccc(CN2CCCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
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TBA
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538516
(CHEMBL4643578)Show SMILES COC(=O)N1CCN(CC1)C(=O)c1ccc(cc1)-c1cnn2c(N)c(c(NC3CC(C)(C)N(C)C(C)(C)C3)nc12)-c1ccccc1 Show InChI InChI=1S/C35H44N8O3/c1-34(2)20-26(21-35(3,4)40(34)5)38-30-28(24-10-8-7-9-11-24)29(36)43-31(39-30)27(22-37-43)23-12-14-25(15-13-23)32(44)41-16-18-42(19-17-41)33(45)46-6/h7-15,22,26H,16-21,36H2,1-6H3,(H,38,39) | UniProtKB/SwissProt
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The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538515
(CHEMBL4636056)Show SMILES [H][C@]12CN(C(=O)c3ccc(cc3)-c3cnn4c(N)c(c(NC5CC(C)(C)N(C)C(C)(C)C5)nc34)-c3ccccc3)[C@]([H])(CO1)C2 |r| Show InChI InChI=1S/C34H41N7O2/c1-33(2)16-24(17-34(3,4)39(33)5)37-30-28(22-9-7-6-8-10-22)29(35)41-31(38-30)27(18-36-41)21-11-13-23(14-12-21)32(42)40-19-26-15-25(40)20-43-26/h6-14,18,24-26H,15-17,19-20,35H2,1-5H3,(H,37,38)/t25-,26-/m0/s1 | UniProtKB/SwissProt
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The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625340
(US20230322769, Compound 17-a)Show SMILES COc1ccc(CN(C)CCN(C)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn(C)c2)cn1 | PDB
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TBA
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50595124
(CHEBI:49960 | Caprelsa | GNF-PF-2188 | NSC-744325 ...)Show SMILES COc1cc2c(cc1OCC1CCN(C)CC1)[nH]cn\c2=N/c1ccc(Br)cc1F | UniProtKB/SwissProt
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Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c02167
BindingDB Entry DOI: 10.7270/Q22R3WQ4 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625351
(US20230322769, Compound 64 | US20230322769, Compou...)Show SMILES COc1ccc(CN2CCCN(CC2)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cc3CCCn3n2)cn1 | PDB
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TBA
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50021574
(BMS-907351 | CABOZANTINIB | CHEBI:72317 | Cabomety...)Show SMILES COc1cc2nccc(Oc3ccc(NC(=O)C4(CC4)C(=O)Nc4ccc(F)cc4)cc3)c2cc1OC Show InChI InChI=1S/C28H24FN3O5/c1-35-24-15-21-22(16-25(24)36-2)30-14-11-23(21)37-20-9-7-19(8-10-20)32-27(34)28(12-13-28)26(33)31-18-5-3-17(29)4-6-18/h3-11,14-16H,12-13H2,1-2H3,(H,31,33)(H,32,34) | UniProtKB/SwissProt
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Citation and Details
Article DOI: 10.1021/acs.jmedchem.0c02167
BindingDB Entry DOI: 10.7270/Q22R3WQ4 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50575351
(CHEMBL4874648)Show SMILES COC(=O)N[C@H]1CC[C@H](CC1)n1cc(-c2ccc(Cl)c(N)c2)c2c(N)ncnc12 |r,wU:8.11,5.4,(7.07,-20.4,;8.57,-20.08,;9.05,-18.61,;10.56,-18.29,;8.02,-17.47,;8.49,-16,;7.46,-14.86,;7.94,-13.4,;9.44,-13.07,;10.48,-14.21,;10,-15.68,;9.91,-11.61,;9,-10.37,;9.9,-9.12,;9.42,-7.66,;7.91,-7.35,;7.43,-5.89,;8.45,-4.74,;7.97,-3.27,;9.96,-5.05,;10.99,-3.9,;10.44,-6.51,;11.36,-9.59,;12.7,-8.81,;12.69,-7.27,;14.03,-9.58,;14.04,-11.13,;12.7,-11.9,;11.37,-11.13,)| | UniProtKB/SwissProt
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TBA
| Assay Description
Inhibition of CCDC6-RET fusion protein (unknown origin) expressed in human LC-2-ad cells assessed as reduction in cell proliferation incubated for 6 ... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.1c00450
BindingDB Entry DOI: 10.7270/Q23R0XP8 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50575350
(CHEMBL4877264)Show SMILES CC(=O)N1CCN(CC1)[C@H]1C[C@H](C1)n1cc(-c2ccc(Cl)c(N)c2)c2c(N)ncnc12 |r,wU:11.14,9.9,(30.61,-31.29,;32.11,-30.97,;33.14,-32.11,;32.59,-29.5,;31.56,-28.36,;32.03,-26.9,;33.54,-26.58,;34.57,-27.71,;34.09,-29.18,;34.01,-25.11,;33.3,-23.74,;34.67,-23.04,;35.38,-24.41,;35.14,-21.56,;34.23,-20.32,;35.13,-19.07,;34.65,-17.62,;33.15,-17.31,;32.66,-15.85,;33.69,-14.69,;33.2,-13.23,;35.2,-15.01,;36.22,-13.86,;35.68,-16.47,;36.59,-19.54,;37.93,-18.77,;37.92,-17.23,;39.27,-19.53,;39.27,-21.08,;37.93,-21.85,;36.6,-21.08,)| | UniProtKB/SwissProt
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TBA
| Assay Description
Inhibition of CCDC6-RET fusion protein (unknown origin) expressed in human LC-2-ad cells assessed as reduction in cell proliferation incubated for 6 ... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.1c00450
BindingDB Entry DOI: 10.7270/Q23R0XP8 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50575353
(CHEMBL4859681)Show SMILES COC(=O)NC12CCC(CC1)(CC2)n1cc(-c2cc(N)c(Cl)cc2F)c2c(N)ncnc12 | UniProtKB/SwissProt
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TBA
| Assay Description
Inhibition of CCDC6-RET fusion protein (unknown origin) expressed in human LC-2-ad cells assessed as reduction in cell proliferation incubated for 6 ... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.1c00450
BindingDB Entry DOI: 10.7270/Q23R0XP8 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538512
(CHEMBL4638840)Show SMILES COc1ccc(cc1OC)-c1cnn2c(N)c(c(NC3CCN(C)CC3)nc12)-c1ccccc1 Show InChI InChI=1S/C26H30N6O2/c1-31-13-11-19(12-14-31)29-25-23(17-7-5-4-6-8-17)24(27)32-26(30-25)20(16-28-32)18-9-10-21(33-2)22(15-18)34-3/h4-10,15-16,19H,11-14,27H2,1-3H3,(H,29,30) | UniProtKB/SwissProt
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The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625341
(US20230322769, Compound 21)Show SMILES COc1ccc(CN2CCC(CC2)Nc2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn(C)c2)cn1 | PDB
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TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM625343
(US20230322769, Compound 34)Show SMILES COc1ccc(CN(C)C2CCCCC2N(C)c2ccc(cn2)-c2cc(cn3ncc(C#N)c23)-c2cnn(C)c2)cn1 | PDB
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Citation and Details
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More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538507
(CHEMBL4640601)Show SMILES COc1ccc(cc1OC)-c1cnn2c(N)c(-c3ccccc3)c(OC3CCN(C)CC3)nc12 Show InChI InChI=1S/C26H29N5O3/c1-30-13-11-19(12-14-30)34-26-23(17-7-5-4-6-8-17)24(27)31-25(29-26)20(16-28-31)18-9-10-21(32-2)22(15-18)33-3/h4-10,15-16,19H,11-14,27H2,1-3H3 | UniProtKB/SwissProt
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| n/a | n/a | 95 | n/a | n/a | n/a | n/a | n/a | n/a |
The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50575352
(CHEMBL4857808)Show SMILES COC(=O)NC12CCC(CC1)(CC2)n1cc(-c2ccc(Cl)c(N)c2)c2c(N)ncnc12 | UniProtKB/SwissProt
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TBA
| Assay Description
Inhibition of CCDC6-RET fusion protein (unknown origin) expressed in human LC-2-ad cells assessed as reduction in cell proliferation incubated for 6 ... |
Citation and Details
Article DOI: 10.1021/acsmedchemlett.1c00450
BindingDB Entry DOI: 10.7270/Q23R0XP8 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50538510
(CHEMBL4640989)Show SMILES COc1ccc(cc1OC)-c1cnn2c(N)c(-c3ccccc3)c(OC3CCNCC3)nc12 Show InChI InChI=1S/C25H27N5O3/c1-31-20-9-8-17(14-21(20)32-2)19-15-28-30-23(26)22(16-6-4-3-5-7-16)25(29-24(19)30)33-18-10-12-27-13-11-18/h3-9,14-15,18,27H,10-13,26H2,1-2H3 | UniProtKB/SwissProt
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The Genomics Institute of the Novartis Research Foundation
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) transfected in human LC2/ad cells assessed as reduction in cell viability incubated for 6 days by CellTiter ... |
ACS Med Chem Lett 11: 558-565 (2020)
Article DOI: 10.1021/acsmedchemlett.0c00015
BindingDB Entry DOI: 10.7270/Q29S1VJ7 |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6/Proto-oncogene tyrosine-protein kinase receptor Ret
(Homo sapiens (Human)) | BDBM50322535
(3-(imidazo[1,2-b]pyridazin-3-ylethynyl)-4-methyl-N...)Show SMILES CN1CCN(Cc2ccc(NC(=O)c3ccc(C)c(c3)C#Cc3cnc4cccnn34)cc2C(F)(F)F)CC1 Show InChI InChI=1S/C29H27F3N6O/c1-20-5-6-22(16-21(20)8-10-25-18-33-27-4-3-11-34-38(25)27)28(39)35-24-9-7-23(26(17-24)29(30,31)32)19-37-14-12-36(2)13-15-37/h3-7,9,11,16-18H,12-15,19H2,1-2H3,(H,35,39) | PDB
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Ocean University of China
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) expressed in mouse BaF3 cells assessed as reduction in cell proliferation after 72 hrs by MTT assay |
Bioorg Med Chem Lett 26: 5679-5684 (2016)
Article DOI: 10.1016/j.bmcl.2016.10.061
BindingDB Entry DOI: 10.7270/Q2J1054S |
More data for this
Ligand-Target Pair | |
Coiled-coil domain-containing protein 6
(Homo sapiens (Human)) | BDBM50203455
(CHEMBL3906151)Show SMILES CN1CCN(Cc2ccc(NC(=O)c3ccc(Cl)c(c3)-c3noc(n3)-c3cncc(c3)-c3cnn(C)c3)cc2C(F)(F)F)CC1 Show InChI InChI=1S/C31H28ClF3N8O2/c1-41-7-9-43(10-8-41)18-20-3-5-24(13-26(20)31(33,34)35)38-29(44)19-4-6-27(32)25(12-19)28-39-30(45-40-28)22-11-21(14-36-15-22)23-16-37-42(2)17-23/h3-6,11-17H,7-10,18H2,1-2H3,(H,38,44) | UniProtKB/SwissProt
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| n/a | n/a | 407 | n/a | n/a | n/a | n/a | n/a | n/a |
Ocean University of China
Curated by ChEMBL
| Assay Description
Inhibition of CCDC6/RET (unknown origin) expressed in mouse BaF3 cells assessed as reduction in cell proliferation after 72 hrs by MTT assay |
Bioorg Med Chem Lett 26: 5679-5684 (2016)
Article DOI: 10.1016/j.bmcl.2016.10.061
BindingDB Entry DOI: 10.7270/Q2J1054S |
More data for this
Ligand-Target Pair | |
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