Found 3 hits for monomerid = 356662 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)) | BDBM356662
(US10213433, Compound 44 | US11369599, Compound 44 ...)Show SMILES CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CC[C@@H](CC4)N4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |wU:28.28,wD:31.35,t:4,(3.59,13.27,;2.82,11.93,;4.36,11.93,;1.48,12.71,;.15,11.93,;.15,10.39,;-1.18,9.63,;-1.18,8.08,;-2.52,7.32,;-2.52,5.78,;-1.18,5,;.15,5.78,;.15,7.32,;-1.18,3.46,;-2.52,2.7,;-2.52,1.16,;-1.18,.38,;-1.18,-1.16,;-2.52,-1.93,;.15,-1.93,;.15,-3.46,;-1.39,-3.46,;1.69,-3.46,;.15,-5,;-1.18,-5.78,;-1.18,-7.32,;.15,-8.08,;.15,-9.63,;-1.18,-10.39,;-1.18,-11.93,;-2.52,-12.71,;-3.85,-11.93,;-3.85,-10.39,;-2.52,-9.63,;-5.19,-12.71,;-5.19,-14.24,;-6.52,-15.01,;-7.85,-14.24,;-7.85,-12.71,;-6.52,-11.93,;1.48,-7.32,;1.48,-5.78,;2.82,-8.08,;2.05,-9.42,;3.59,-6.75,;4.15,-8.86,;5.48,-8.08,;4.15,-10.39,;5.48,-9.63,;.15,1.16,;1.48,.38,;2.82,1.16,;2.82,2.7,;4.15,3.46,;5.48,2.7,;6.95,3.17,;7.85,1.93,;6.95,.68,;5.48,1.16,;4.15,.38,;.15,2.7,;1.48,9.63,;2.82,10.39,;-1.18,12.71,;-2.52,11.93,;-3.85,12.71,;-3.85,14.24,;-5.19,15.01,;-2.52,15.01,;-1.18,14.24,)| Show InChI InChI=1S/C49H55ClF3N7O8S2/c1-48(2)28-42(32-3-5-35(50)6-4-32)34(31-67-48)30-58-17-19-59(20-18-58)38-11-13-41(44(26-38)68-39-25-33-15-16-54-46(33)55-29-39)47(61)57-70(64,65)40-12-14-43(45(27-40)69(62,63)49(51,52)53)56-36-7-9-37(10-8-36)60-21-23-66-24-22-60/h3-6,11-16,25-27,29,36-37,56H,7-10,17-24,28,30-31H2,1-2H3,(H,54,55)(H,57,61)/t36-,37- | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| US Patent
| <0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
AbbVie Inc.
US Patent
| Assay Description
TR-FRET (Time-Resolved Fluorescence-Resonance-Energy-Transfer) assay. |
US Patent US10213433 (2019)
BindingDB Entry DOI: 10.7270/Q23F4RZ6 |
More data for this
Ligand-Target Pair | |
Apoptosis regulator Bcl-2
(Homo sapiens (Human)) | BDBM356662
(US10213433, Compound 44 | US11369599, Compound 44 ...)Show SMILES CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CC[C@@H](CC4)N4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |wU:28.28,wD:31.35,t:4,(3.59,13.27,;2.82,11.93,;4.36,11.93,;1.48,12.71,;.15,11.93,;.15,10.39,;-1.18,9.63,;-1.18,8.08,;-2.52,7.32,;-2.52,5.78,;-1.18,5,;.15,5.78,;.15,7.32,;-1.18,3.46,;-2.52,2.7,;-2.52,1.16,;-1.18,.38,;-1.18,-1.16,;-2.52,-1.93,;.15,-1.93,;.15,-3.46,;-1.39,-3.46,;1.69,-3.46,;.15,-5,;-1.18,-5.78,;-1.18,-7.32,;.15,-8.08,;.15,-9.63,;-1.18,-10.39,;-1.18,-11.93,;-2.52,-12.71,;-3.85,-11.93,;-3.85,-10.39,;-2.52,-9.63,;-5.19,-12.71,;-5.19,-14.24,;-6.52,-15.01,;-7.85,-14.24,;-7.85,-12.71,;-6.52,-11.93,;1.48,-7.32,;1.48,-5.78,;2.82,-8.08,;2.05,-9.42,;3.59,-6.75,;4.15,-8.86,;5.48,-8.08,;4.15,-10.39,;5.48,-9.63,;.15,1.16,;1.48,.38,;2.82,1.16,;2.82,2.7,;4.15,3.46,;5.48,2.7,;6.95,3.17,;7.85,1.93,;6.95,.68,;5.48,1.16,;4.15,.38,;.15,2.7,;1.48,9.63,;2.82,10.39,;-1.18,12.71,;-2.52,11.93,;-3.85,12.71,;-3.85,14.24,;-5.19,15.01,;-2.52,15.01,;-1.18,14.24,)| Show InChI InChI=1S/C49H55ClF3N7O8S2/c1-48(2)28-42(32-3-5-35(50)6-4-32)34(31-67-48)30-58-17-19-59(20-18-58)38-11-13-41(44(26-38)68-39-25-33-15-16-54-46(33)55-29-39)47(61)57-70(64,65)40-12-14-43(45(27-40)69(62,63)49(51,52)53)56-36-7-9-37(10-8-36)60-21-23-66-24-22-60/h3-6,11-16,25-27,29,36-37,56H,7-10,17-24,28,30-31H2,1-2H3,(H,54,55)(H,57,61)/t36-,37- | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | <0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Apoptosis regulator Bcl-2
(Homo sapiens (Human)) | BDBM356662
(US10213433, Compound 44 | US11369599, Compound 44 ...)Show SMILES CC1(C)CC(=C(CN2CCN(CC2)c2ccc(C(=O)NS(=O)(=O)c3ccc(N[C@H]4CC[C@@H](CC4)N4CCOCC4)c(c3)S(=O)(=O)C(F)(F)F)c(Oc3cnc4[nH]ccc4c3)c2)CO1)c1ccc(Cl)cc1 |wU:28.28,wD:31.35,t:4,(3.59,13.27,;2.82,11.93,;4.36,11.93,;1.48,12.71,;.15,11.93,;.15,10.39,;-1.18,9.63,;-1.18,8.08,;-2.52,7.32,;-2.52,5.78,;-1.18,5,;.15,5.78,;.15,7.32,;-1.18,3.46,;-2.52,2.7,;-2.52,1.16,;-1.18,.38,;-1.18,-1.16,;-2.52,-1.93,;.15,-1.93,;.15,-3.46,;-1.39,-3.46,;1.69,-3.46,;.15,-5,;-1.18,-5.78,;-1.18,-7.32,;.15,-8.08,;.15,-9.63,;-1.18,-10.39,;-1.18,-11.93,;-2.52,-12.71,;-3.85,-11.93,;-3.85,-10.39,;-2.52,-9.63,;-5.19,-12.71,;-5.19,-14.24,;-6.52,-15.01,;-7.85,-14.24,;-7.85,-12.71,;-6.52,-11.93,;1.48,-7.32,;1.48,-5.78,;2.82,-8.08,;2.05,-9.42,;3.59,-6.75,;4.15,-8.86,;5.48,-8.08,;4.15,-10.39,;5.48,-9.63,;.15,1.16,;1.48,.38,;2.82,1.16,;2.82,2.7,;4.15,3.46,;5.48,2.7,;6.95,3.17,;7.85,1.93,;6.95,.68,;5.48,1.16,;4.15,.38,;.15,2.7,;1.48,9.63,;2.82,10.39,;-1.18,12.71,;-2.52,11.93,;-3.85,12.71,;-3.85,14.24,;-5.19,15.01,;-2.52,15.01,;-1.18,14.24,)| Show InChI InChI=1S/C49H55ClF3N7O8S2/c1-48(2)28-42(32-3-5-35(50)6-4-32)34(31-67-48)30-58-17-19-59(20-18-58)38-11-13-41(44(26-38)68-39-25-33-15-16-54-46(33)55-29-39)47(61)57-70(64,65)40-12-14-43(45(27-40)69(62,63)49(51,52)53)56-36-7-9-37(10-8-36)60-21-23-66-24-22-60/h3-6,11-16,25-27,29,36-37,56H,7-10,17-24,28,30-31H2,1-2H3,(H,54,55)(H,57,61)/t36-,37- | PDB
UniProtKB/SwissProt
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| US Patent
| <0.0100 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| Assay Description
The inhibition constant (Ki) for binding of representative compounds to Bcl-2 protein, as determined by a TR-FRET (Time-Resolved Fluorescence-Resonan... |
Citation and Details
BindingDB Entry DOI: 10.7270/Q21V5J59 |
More data for this
Ligand-Target Pair | |
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