Found 2 hits for monomerid = 145133 Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kcal/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Apoptosis regulator Bcl-2
(Homo sapiens (Human)) | BDBM145133
(US8952157, 324 | US9303025, 324)Show SMILES CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(10.75,-11.18,;9.94,-9.88,;11.48,-9.93,;9.94,-8.34,;8.6,-7.57,;7.27,-8.34,;5.94,-7.57,;5.94,-6.03,;7.27,-5.26,;7.27,-3.72,;5.94,-2.95,;4.6,-3.72,;4.6,-5.26,;5.94,-1.41,;7.27,-.64,;7.27,.9,;5.94,1.67,;5.94,3.21,;7.27,3.98,;4.6,3.98,;4.6,5.52,;4.6,7.06,;6.14,5.52,;3.06,5.52,;2.29,4.19,;.75,4.19,;-.02,5.52,;-1.56,5.52,;-2.33,4.19,;-1.56,2.85,;-2.33,1.52,;-3.87,1.52,;-4.64,2.85,;-3.87,4.19,;-4.64,.19,;-3.87,-1.15,;-4.64,-2.48,;-6.18,-2.48,;-6.95,-1.15,;-6.18,.19,;.75,6.86,;2.29,6.86,;-.02,8.19,;.75,9.52,;-1.56,8.19,;4.6,.9,;3.27,1.67,;1.94,.9,;.6,1.67,;-.73,.9,;-.73,-.64,;-2.06,-1.41,;.6,-1.41,;.6,-2.95,;1.94,-.64,;4.6,-.64,;7.27,-9.88,;8.6,-10.65,;5.94,-10.65,;5.94,-12.19,;4.6,-12.96,;3.27,-12.19,;1.94,-12.96,;3.27,-10.65,;4.6,-9.88,)| Show InChI InChI=1S/C47H56Cl2N8O7S/c1-47(2)16-15-32(40(28-47)31-3-5-33(48)6-4-31)30-54-17-19-55(20-18-54)36-11-13-39(44(25-36)64-37-26-41(49)45(50)51-29-37)46(58)53-65(61,62)38-12-14-42(43(27-38)57(59)60)52-34-7-9-35(10-8-34)56-21-23-63-24-22-56/h3-6,11-14,25-27,29,34-35,52H,7-10,15-24,28,30H2,1-2H3,(H2,50,51)(H,53,58) | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
Similars
| US Patent
| <0.0100 | <-15.0 | n/a | n/a | n/a | n/a | n/a | n/a | 25 |
AbbVie Inc.
US Patent
| Assay Description
Representative compounds were serially diluted in dimethyl sulfoxide (DMSO) starting at 50 μM (2× starting concentration; 10% DMSO) and 10 μ... |
US Patent US9303025 (2016)
BindingDB Entry DOI: 10.7270/Q2XD10JP |
More data for this
Ligand-Target Pair | |
Apoptosis regulator Bcl-2
(Homo sapiens (Human)) | BDBM145133
(US8952157, 324 | US9303025, 324)Show SMILES CC1(C)CCC(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(NC4CCC(CC4)N4CCOCC4)c(c3)[N+]([O-])=O)c(Oc3cnc(N)c(Cl)c3)c2)=C(C1)c1ccc(Cl)cc1 |c:61,(10.75,-11.18,;9.94,-9.88,;11.48,-9.93,;9.94,-8.34,;8.6,-7.57,;7.27,-8.34,;5.94,-7.57,;5.94,-6.03,;7.27,-5.26,;7.27,-3.72,;5.94,-2.95,;4.6,-3.72,;4.6,-5.26,;5.94,-1.41,;7.27,-.64,;7.27,.9,;5.94,1.67,;5.94,3.21,;7.27,3.98,;4.6,3.98,;4.6,5.52,;4.6,7.06,;6.14,5.52,;3.06,5.52,;2.29,4.19,;.75,4.19,;-.02,5.52,;-1.56,5.52,;-2.33,4.19,;-1.56,2.85,;-2.33,1.52,;-3.87,1.52,;-4.64,2.85,;-3.87,4.19,;-4.64,.19,;-3.87,-1.15,;-4.64,-2.48,;-6.18,-2.48,;-6.95,-1.15,;-6.18,.19,;.75,6.86,;2.29,6.86,;-.02,8.19,;.75,9.52,;-1.56,8.19,;4.6,.9,;3.27,1.67,;1.94,.9,;.6,1.67,;-.73,.9,;-.73,-.64,;-2.06,-1.41,;.6,-1.41,;.6,-2.95,;1.94,-.64,;4.6,-.64,;7.27,-9.88,;8.6,-10.65,;5.94,-10.65,;5.94,-12.19,;4.6,-12.96,;3.27,-12.19,;1.94,-12.96,;3.27,-10.65,;4.6,-9.88,)| Show InChI InChI=1S/C47H56Cl2N8O7S/c1-47(2)16-15-32(40(28-47)31-3-5-33(48)6-4-31)30-54-17-19-55(20-18-54)36-11-13-39(44(25-36)64-37-26-41(49)45(50)51-29-37)46(58)53-65(61,62)38-12-14-42(43(27-38)57(59)60)52-34-7-9-35(10-8-34)56-21-23-63-24-22-56/h3-6,11-14,25-27,29,34-35,52H,7-10,15-24,28,30H2,1-2H3,(H2,50,51)(H,53,58) | PDB
UniProtKB/SwissProt
UniProtKB/TrEMBL
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
Similars
| US Patent
| <0.0100 | <-15.0 | n/a | n/a | n/a | n/a | n/a | n/a | 25 |
AbbVie Inc.; The Walter and Eliza Hall Institute of Medical Research
US Patent
| Assay Description
Representative compounds were serially diluted in dimethyl sulfoxide (DMSO) starting at 50 uM (2x starting concentration; 10% DMSO) and 10 uL were tr... |
US Patent US8952157 (2015)
BindingDB Entry DOI: 10.7270/Q2QN65G9 |
More data for this
Ligand-Target Pair | |
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