Found 2 hits Enz. Inhib. hit(s) with Target = 'Telomeric repeat-binding factor 2-interacting protein 1' and Ligand = 'BDBM50136312' 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)) | BDBM50136312
(CHEMBL3753717)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)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](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(N)=O |r| Show InChI InChI=1S/C76H133N19O20S/c1-15-41(6)58(92-76(115)62(47(12)99)95-75(114)59(44(9)96)84-48(13)100)72(111)81-38-57(101)85-53(30-34-116-14)67(106)86-51(28-20-23-32-78)68(107)94-61(46(11)98)74(113)91-55(36-40(4)5)70(109)87-50(27-19-22-31-77)66(105)83-42(7)64(103)82-43(8)65(104)90-56(37-49-25-17-16-18-26-49)71(110)88-52(29-21-24-33-79)69(108)93-60(45(10)97)73(112)89-54(63(80)102)35-39(2)3/h16-18,25-26,39-47,50-56,58-62,96-99H,15,19-24,27-38,77-79H2,1-14H3,(H2,80,102)(H,81,111)(H,82,103)(H,83,105)(H,84,100)(H,85,101)(H,86,106)(H,87,109)(H,88,110)(H,89,112)(H,90,104)(H,91,113)(H,92,115)(H,93,108)(H,94,107)(H,95,114)/t41-,42-,43-,44+,45+,46+,47+,50-,51-,52-,53-,54-,55-,56-,58-,59-,60-,61-,62-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| 5.80E+3 | 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)) | BDBM50136312
(CHEMBL3753717)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(C)=O)[C@@H](C)O)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCSC)C(=O)N[C@@H](CCCCN)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](C)C(=O)N[C@@H](C)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(N)=O |r| Show InChI InChI=1S/C76H133N19O20S/c1-15-41(6)58(92-76(115)62(47(12)99)95-75(114)59(44(9)96)84-48(13)100)72(111)81-38-57(101)85-53(30-34-116-14)67(106)86-51(28-20-23-32-78)68(107)94-61(46(11)98)74(113)91-55(36-40(4)5)70(109)87-50(27-19-22-31-77)66(105)83-42(7)64(103)82-43(8)65(104)90-56(37-49-25-17-16-18-26-49)71(110)88-52(29-21-24-33-79)69(108)93-60(45(10)97)73(112)89-54(63(80)102)35-39(2)3/h16-18,25-26,39-47,50-56,58-62,96-99H,15,19-24,27-38,77-79H2,1-14H3,(H2,80,102)(H,81,111)(H,82,103)(H,83,105)(H,84,100)(H,85,101)(H,86,106)(H,87,109)(H,88,110)(H,89,112)(H,90,104)(H,91,113)(H,92,115)(H,93,108)(H,94,107)(H,95,114)/t41-,42-,43-,44+,45+,46+,47+,50-,51-,52-,53-,54-,55-,56-,58-,59-,60-,61-,62-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| CHEMBL
PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | 2.70E+4 | 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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