BDBM34699 3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-(3-oxidanylpiperidin-1-yl)-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile::3-(1-adamantyl)-5,6-diamino-8-(3-hydroxy-1-piperidinyl)-2-oxo-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile::3-(1-adamantyl)-5,6-diamino-8-(3-hydroxypiperidin-1-yl)-2-oxo-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile::3-(1-adamantyl)-5,6-diamino-8-(3-hydroxypiperidino)-2-keto-1H-pyrrolo[2,3-c][2,7]naphthyridine-9-carbonitrile::MLS000536166::SMR000155469::cid_3962922

SMILES: [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21

InChI Key: InChIKey=KZXIXPOPZHAIFY-UHFFFAOYSA-N

Data: 5 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 5 hits for monomerid = 34699   

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
MPI protein (Homo sapiens (Human))	BDBM34699 (3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-...) Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| Show InChI InChI=1S/C26H31N7O2/c27-11-18-20-17-7-19(35)33(26-8-13-4-14(9-26)6-15(5-13)10-26)25(17)31-23(29)21(20)22(28)30-24(18)32-3-1-2-16(34)12-32/h13-16,34H,1-10,12H2,(H2,28,30)(H2,29,31)	Reactome pathway KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	7.4	23
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description The purpose of this assay is to identify non-competititve inhibitors of human PMI. This is accomplished by using a G6PD- NADPH-coupled assay. In the ...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2CF9NFM
					More data for this Ligand-Target Pair
Mu-type opioid receptor (Homo sapiens (Human))	BDBM34699 (3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-...) Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| Show InChI InChI=1S/C26H31N7O2/c27-11-18-20-17-7-19(35)33(26-8-13-4-14(9-26)6-15(5-13)10-26)25(17)31-23(29)21(20)22(28)30-24(18)32-3-1-2-16(34)12-32/h13-16,34H,1-10,12H2,(H2,28,30)(H2,29,31)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>6.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2QN656Q
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM34699 (3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-...) Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| Show InChI InChI=1S/C26H31N7O2/c27-11-18-20-17-7-19(35)33(26-8-13-4-14(9-26)6-15(5-13)10-26)25(17)31-23(29)21(20)22(28)30-24(18)32-3-1-2-16(34)12-32/h13-16,34H,1-10,12H2,(H2,28,30)(H2,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2F18X8S
					More data for this Ligand-Target Pair
Apoptotic peptidase activating factor 1 (Homo sapiens (Human))	BDBM34699 (3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-...) Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| Show InChI InChI=1S/C26H31N7O2/c27-11-18-20-17-7-19(35)33(26-8-13-4-14(9-26)6-15(5-13)10-26)25(17)31-23(29)21(20)22(28)30-24(18)32-3-1-2-16(34)12-32/h13-16,34H,1-10,12H2,(H2,28,30)(H2,29,31)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	7.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBIMR, San Diego, C...				PubChem Bioassay (2011) BindingDB Entry DOI: 10.7270/Q2JS9NZB
					More data for this Ligand-Target Pair
BZLF1 (Human herpesvirus 4)	BDBM34699 (3-(1-adamantyl)-5,6-bis(azanyl)-2-oxidanylidene-8-...) Show SMILES [H]C12CC3([H])CC([H])(C1)CC(C2)(C3)N1C(=O)Cc2c1nc(N)c1c(N)nc(N3CCCC(O)C3)c(C#N)c21 |TLB:5:3:11:6.9.8,THB:2:3:9:1.11.8,2:1:9:3.12.5| Show InChI InChI=1S/C26H31N7O2/c27-11-18-20-17-7-19(35)33(26-8-13-4-14(9-26)6-15(5-13)10-26)25(17)31-23(29)21(20)22(28)30-24(18)32-3-1-2-16(34)12-32/h13-16,34H,1-10,12H2,(H2,28,30)(H2,29,31)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	2.95E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2BC3X0T
					More data for this Ligand-Target Pair