Found 2 hits Enz. Inhib. hit(s) with Target = 'Telomeric repeat-binding factor 2-interacting protein 1' and Ligand = 'BDBM50136310' 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 |
|---|
Telomeric repeat-binding factor 2-interacting protein 1
(Homo sapiens (Human)) | BDBM50136310
(CHEMBL3754578)Show SMILES CSCC[C@H](NC(=O)CNC(=O)C(CC(C)(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1CCCCn2cc(C[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](C)NC1=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)nn2 |r| Show InChI InChI=1S/C83H140N22O21S2/c1-44(2)36-58(77(121)100-63(43-106)68(86)112)96-79(123)61-39-52-42-105(104-103-52)33-23-20-28-53(71(115)88-46(5)69(113)95-60(38-51-24-16-15-17-25-51)78(122)93-55(73(117)97-61)27-19-22-32-85)91-72(116)54(26-18-21-31-84)92-76(120)59(37-45(3)4)98-80(124)66(48(7)108)101-75(119)57(30-35-128-14)94-74(118)56(29-34-127-13)90-64(111)41-87-70(114)62(40-83(10,11)12)99-81(125)67(49(8)109)102-82(126)65(47(6)107)89-50(9)110/h15-17,24-25,42,44-49,53-63,65-67,106-109H,18-23,26-41,43,84-85H2,1-14H3,(H2,86,112)(H,87,114)(H,88,115)(H,89,110)(H,90,111)(H,91,116)(H,92,120)(H,93,122)(H,94,118)(H,95,113)(H,96,123)(H,97,117)(H,98,124)(H,99,125)(H,100,121)(H,101,119)(H,102,126)/t46-,47+,48+,49+,53-,54-,55-,56-,57-,58-,59-,60-,61+,62?,63-,65-,66-,67-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| 53 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan
Curated by ChEMBL
| Assay Description
Competitive binding to RAP1 (unknown origin) incubated for 1 hr by fluorescence polarization-based binding assay |
J Med Chem 59: 328-34 (2016)
Article DOI: 10.1021/acs.jmedchem.5b01465
BindingDB Entry DOI: 10.7270/Q2MP553D |
More data for this
Ligand-Target Pair | |
Telomeric repeat-binding factor 2-interacting protein 1
(Homo sapiens (Human)) | BDBM50136310
(CHEMBL3754578)Show SMILES CSCC[C@H](NC(=O)CNC(=O)C(CC(C)(C)C)NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCSC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@H]1CCCCn2cc(C[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc3ccccc3)NC(=O)[C@H](C)NC1=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(N)=O)nn2 |r| Show InChI InChI=1S/C83H140N22O21S2/c1-44(2)36-58(77(121)100-63(43-106)68(86)112)96-79(123)61-39-52-42-105(104-103-52)33-23-20-28-53(71(115)88-46(5)69(113)95-60(38-51-24-16-15-17-25-51)78(122)93-55(73(117)97-61)27-19-22-32-85)91-72(116)54(26-18-21-31-84)92-76(120)59(37-45(3)4)98-80(124)66(48(7)108)101-75(119)57(30-35-128-14)94-74(118)56(29-34-127-13)90-64(111)41-87-70(114)62(40-83(10,11)12)99-81(125)67(49(8)109)102-82(126)65(47(6)107)89-50(9)110/h15-17,24-25,42,44-49,53-63,65-67,106-109H,18-23,26-41,43,84-85H2,1-14H3,(H2,86,112)(H,87,114)(H,88,115)(H,89,110)(H,90,111)(H,91,116)(H,92,120)(H,93,122)(H,94,118)(H,95,113)(H,96,123)(H,97,117)(H,98,124)(H,99,125)(H,100,121)(H,101,119)(H,102,126)/t46-,47+,48+,49+,53-,54-,55-,56-,57-,58-,59-,60-,61+,62?,63-,65-,66-,67-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
Similars
| Article
PubMed
| n/a | n/a | 280 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Michigan
Curated by ChEMBL
| Assay Description
Competitive binding to RAP1 (unknown origin) incubated for 1 hr by fluorescence polarization-based binding assay |
J Med Chem 59: 328-34 (2016)
Article DOI: 10.1021/acs.jmedchem.5b01465
BindingDB Entry DOI: 10.7270/Q2MP553D |
More data for this
Ligand-Target Pair | |
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