BDBM130051 US8815927, SM-1267

SMILES: CN[C@@H](C)C(=O)N[C@H]1CN(CC[C@H]2CC[C@H](N2C1=O)c1nc2c(cccc2[nH]1)-c1ccccc1)C(=O)CCCCCCCCC(=O)N1CC[C@H]2CC[C@H](N2C(=O)[C@H](C1)NC(=O)[C@H](C)NC)c1nc2c(cccc2[nH]1)-c1ccccc1

InChI Key: InChIKey=WXBHQQMXKHAAIH-LLUFGHGUSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 130051   

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
Baculoviral IAP repeat-containing protein 3 (IAP1 BIR3) (Homo sapiens (Human))	BDBM130051 (US8815927, SM-1267) Show SMILES CN[C@@H](C)C(=O)N[C@H]1CN(CC[C@H]2CC[C@H](N2C1=O)c1nc2c(cccc2[nH]1)-c1ccccc1)C(=O)CCCCCCCCC(=O)N1CC[C@H]2CC[C@H](N2C(=O)[C@H](C1)NC(=O)[C@H](C)NC)c1nc2c(cccc2[nH]1)-c1ccccc1 |r| Show InChI InChI=1S/C62H78N12O6/c1-39(63-3)59(77)67-49-37-71(35-33-43-29-31-51(73(43)61(49)79)57-65-47-25-17-23-45(55(47)69-57)41-19-11-9-12-20-41)53(75)27-15-7-5-6-8-16-28-54(76)72-36-34-44-30-32-52(74(44)62(80)50(38-72)68-60(78)40(2)64-4)58-66-48-26-18-24-46(56(48)70-58)42-21-13-10-14-22-42/h9-14,17-26,39-40,43-44,49-52,63-64H,5-8,15-16,27-38H2,1-4H3,(H,65,69)(H,66,70)(H,67,77)(H,68,78)/t39-,40-,43+,44+,49-,50-,51-,52-/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<10	n/a	n/a	n/a	n/a	n/a	n/a
The Regents of the University of Michigan US Patent					Assay Description An in vitro fluorescence polarization (FP) based binding assay was used to test the binding ability of the compounds of the present invention to cert...				US Patent US8815927 (2014) BindingDB Entry DOI: 10.7270/Q25X27M6
					More data for this Ligand-Target Pair
cIAP-2 BIR3 (Homo sapiens (Human))	BDBM130051 (US8815927, SM-1267) Show SMILES CN[C@@H](C)C(=O)N[C@H]1CN(CC[C@H]2CC[C@H](N2C1=O)c1nc2c(cccc2[nH]1)-c1ccccc1)C(=O)CCCCCCCCC(=O)N1CC[C@H]2CC[C@H](N2C(=O)[C@H](C1)NC(=O)[C@H](C)NC)c1nc2c(cccc2[nH]1)-c1ccccc1 |r| Show InChI InChI=1S/C62H78N12O6/c1-39(63-3)59(77)67-49-37-71(35-33-43-29-31-51(73(43)61(49)79)57-65-47-25-17-23-45(55(47)69-57)41-19-11-9-12-20-41)53(75)27-15-7-5-6-8-16-28-54(76)72-36-34-44-30-32-52(74(44)62(80)50(38-72)68-60(78)40(2)64-4)58-66-48-26-18-24-46(56(48)70-58)42-21-13-10-14-22-42/h9-14,17-26,39-40,43-44,49-52,63-64H,5-8,15-16,27-38H2,1-4H3,(H,65,69)(H,66,70)(H,67,77)(H,68,78)/t39-,40-,43+,44+,49-,50-,51-,52-/m0/s1	PDB MMDB KEGG B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	<50	n/a	n/a	n/a	n/a	n/a	n/a
The Regents of the University of Michigan US Patent					Assay Description An in vitro fluorescence polarization (FP) based binding assay was used to test the binding ability of the compounds of the present invention to cert...				US Patent US8815927 (2014) BindingDB Entry DOI: 10.7270/Q25X27M6
					More data for this Ligand-Target Pair