BDBM50139194 CHEMBL345474::N-(adamantan-2-yl)-10-cyano-23-oxo-8-oxa-1,15,17,21-tetraazapentacyclo[19.2.2.1^{3,7}.1^{9,13}.0^{15,19}]heptacosa-3(27),4,6,9(26),10,12,16,18-octaene-4-carboxamide

SMILES: O=C(NC1C2CC3CC(C2)CC1C3)c1ccc2Oc3cc(Cn4cncc4CN4CCN(Cc1c2)C(=O)C4)ccc3C#N

InChI Key: InChIKey=YOSWFXLZVOUMIC-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50139194   

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
Geranylgeranyl transferase type I beta subunit/Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50139194 (CHEMBL345474 | N-(adamantan-2-yl)-10-cyano-23-oxo-...) Show SMILES O=C(NC1C2CC3CC(C2)CC1C3)c1ccc2Oc3cc(Cn4cncc4CN4CCN(Cc1c2)C(=O)C4)ccc3C#N |TLB:2:3:5:8.9.7,THB:2:3:6.5.12:8.10.9,7:6:3:8.10.9,7:8:3:6.5.12,10:11:5:8.9.7,10:8:5:3.11.12,(8.51,2.5,;9.26,1.16,;10.81,1.15,;11.58,2.49,;13.07,2.91,;14.48,2.35,;15.5,3.62,;15.51,5.16,;14.1,5.74,;13.07,4.5,;12.75,5.25,;12.77,3.78,;14.1,3.29,;8.47,-.19,;9.24,-1.53,;8.47,-2.86,;6.93,-2.86,;4.87,-5.99,;3.4,-5.55,;3.05,-4.04,;1.57,-3.58,;1.22,-2.09,;-.25,-1.64,;-1.44,-2.62,;-2.73,-1.78,;-2.35,-.29,;-.81,-.19,;-.04,1.14,;1.5,1.14,;2.28,2.48,;3.83,2.48,;4.6,1.14,;6.16,1.14,;6.93,-.19,;6.16,-1.53,;3.83,-.19,;4.63,-1.54,;2.28,-.19,;.45,-4.64,;.79,-6.13,;2.28,-6.59,;2.62,-8.1,;2.95,-9.62,)| Show InChI InChI=1S/C34H36N6O3/c35-14-24-2-1-21-12-31(24)43-29-3-4-30(34(42)37-33-25-8-22-7-23(10-25)11-26(33)9-22)27(13-29)17-39-6-5-38(19-32(39)41)18-28-15-36-20-40(28)16-21/h1-4,12-13,15,20,22-23,25-26,33H,5-11,16-19H2,(H,37,42)	PDB KEGG UniProtKB/SwissProt B.MOAD antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human Geranylgeranyl transferase type I incorporation of [3H]-GGPP into biotinylated peptide corresponding to the C-terminus of human K...				Bioorg Med Chem Lett 14: 639-43 (2004) BindingDB Entry DOI: 10.7270/Q2WM1CTK
					More data for this Ligand-Target Pair
Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50139194 (CHEMBL345474 | N-(adamantan-2-yl)-10-cyano-23-oxo-...) Show SMILES O=C(NC1C2CC3CC(C2)CC1C3)c1ccc2Oc3cc(Cn4cncc4CN4CCN(Cc1c2)C(=O)C4)ccc3C#N |TLB:2:3:5:8.9.7,THB:2:3:6.5.12:8.10.9,7:6:3:8.10.9,7:8:3:6.5.12,10:11:5:8.9.7,10:8:5:3.11.12,(8.51,2.5,;9.26,1.16,;10.81,1.15,;11.58,2.49,;13.07,2.91,;14.48,2.35,;15.5,3.62,;15.51,5.16,;14.1,5.74,;13.07,4.5,;12.75,5.25,;12.77,3.78,;14.1,3.29,;8.47,-.19,;9.24,-1.53,;8.47,-2.86,;6.93,-2.86,;4.87,-5.99,;3.4,-5.55,;3.05,-4.04,;1.57,-3.58,;1.22,-2.09,;-.25,-1.64,;-1.44,-2.62,;-2.73,-1.78,;-2.35,-.29,;-.81,-.19,;-.04,1.14,;1.5,1.14,;2.28,2.48,;3.83,2.48,;4.6,1.14,;6.16,1.14,;6.93,-.19,;6.16,-1.53,;3.83,-.19,;4.63,-1.54,;2.28,-.19,;.45,-4.64,;.79,-6.13,;2.28,-6.59,;2.62,-8.1,;2.95,-9.62,)| Show InChI InChI=1S/C34H36N6O3/c35-14-24-2-1-21-12-31(24)43-29-3-4-30(34(42)37-33-25-8-22-7-23(10-25)11-26(33)9-22)27(13-29)17-39-6-5-38(19-32(39)41)18-28-15-36-20-40(28)16-21/h1-4,12-13,15,20,22-23,25-26,33H,5-11,16-19H2,(H,37,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of human Farnesyltransferase -catalyzed incorporation of [3H]-FPP into recombinant Ras-CVIM.				Bioorg Med Chem Lett 14: 639-43 (2004) BindingDB Entry DOI: 10.7270/Q2WM1CTK
					More data for this Ligand-Target Pair
Protein Farnesyltransferase (PFT) (Homo sapiens (Human))	BDBM50139194 (CHEMBL345474 | N-(adamantan-2-yl)-10-cyano-23-oxo-...) Show SMILES O=C(NC1C2CC3CC(C2)CC1C3)c1ccc2Oc3cc(Cn4cncc4CN4CCN(Cc1c2)C(=O)C4)ccc3C#N |TLB:2:3:5:8.9.7,THB:2:3:6.5.12:8.10.9,7:6:3:8.10.9,7:8:3:6.5.12,10:11:5:8.9.7,10:8:5:3.11.12,(8.51,2.5,;9.26,1.16,;10.81,1.15,;11.58,2.49,;13.07,2.91,;14.48,2.35,;15.5,3.62,;15.51,5.16,;14.1,5.74,;13.07,4.5,;12.75,5.25,;12.77,3.78,;14.1,3.29,;8.47,-.19,;9.24,-1.53,;8.47,-2.86,;6.93,-2.86,;4.87,-5.99,;3.4,-5.55,;3.05,-4.04,;1.57,-3.58,;1.22,-2.09,;-.25,-1.64,;-1.44,-2.62,;-2.73,-1.78,;-2.35,-.29,;-.81,-.19,;-.04,1.14,;1.5,1.14,;2.28,2.48,;3.83,2.48,;4.6,1.14,;6.16,1.14,;6.93,-.19,;6.16,-1.53,;3.83,-.19,;4.63,-1.54,;2.28,-.19,;.45,-4.64,;.79,-6.13,;2.28,-6.59,;2.62,-8.1,;2.95,-9.62,)| Show InChI InChI=1S/C34H36N6O3/c35-14-24-2-1-21-12-31(24)43-29-3-4-30(34(42)37-33-25-8-22-7-23(10-25)11-26(33)9-22)27(13-29)17-39-6-5-38(19-32(39)41)18-28-15-36-20-40(28)16-21/h1-4,12-13,15,20,22-23,25-26,33H,5-11,16-19H2,(H,37,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	PubMed	n/a	n/a	30	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Displacement of radiolabeled FTI from Farnesyltransferase in cultured Ha-ras transformed RAT1 cells.				Bioorg Med Chem Lett 14: 639-43 (2004) BindingDB Entry DOI: 10.7270/Q2WM1CTK
					More data for this Ligand-Target Pair