BDBM287823 6-(3,4-dihydro-2H- chromen-2-ylcarbonyl)-8- morpholin-4-yl-6,11- dihydro-5H-pyrido[2,3- b][1,5]benzodiazepine::US10086000, Example 41::US10508108, Example 41

SMILES: O=C(C1CCc2ccccc2O1)N1Cc2cccnc2Nc2ccc(cc12)N1CCOCC1

InChI Key: InChIKey=YKXYFKWKXJMBAT-UHFFFAOYSA-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 = 287823   

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
IDH1 R132H (Homo sapiens (Human))	BDBM287823 (6-(3,4-dihydro-2H- chromen-2-ylcarbonyl)-8- morpho...) Show SMILES O=C(C1CCc2ccccc2O1)N1Cc2cccnc2Nc2ccc(cc12)N1CCOCC1 Show InChI InChI=1S/C26H26N4O3/c31-26(24-10-7-18-4-1-2-6-23(18)33-24)30-17-19-5-3-11-27-25(19)28-21-9-8-20(16-22(21)30)29-12-14-32-15-13-29/h1-6,8-9,11,16,24H,7,10,12-15,17H2,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Merck Sharp & Dohme Corp. US Patent					Assay Description Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series. 125 nL of each dilution or DMSO alone is disp...				US Patent US10508108 (2019) BindingDB Entry DOI: 10.7270/Q2N018X9
					More data for this Ligand-Target Pair
IDH1 R132H (Homo sapiens (Human))	BDBM287823 (6-(3,4-dihydro-2H- chromen-2-ylcarbonyl)-8- morpho...) Show SMILES O=C(C1CCc2ccccc2O1)N1Cc2cccnc2Nc2ccc(cc12)N1CCOCC1 Show InChI InChI=1S/C26H26N4O3/c31-26(24-10-7-18-4-1-2-6-23(18)33-24)30-17-19-5-3-11-27-25(19)28-21-9-8-20(16-22(21)30)29-12-14-32-15-13-29/h1-6,8-9,11,16,24H,7,10,12-15,17H2,(H,27,28)	PDB GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	95	n/a	n/a	n/a	n/a	7.0	25
Merck Sharp & Dohme Corp. US Patent					Assay Description Each test compound (10 mM stock in DMSO) is diluted in DMSO to make a 10-point, 3-fold dilution series. 125 nL of each dilution or DMSO alone is disp...				US Patent US10086000 (2018) BindingDB Entry DOI: 10.7270/Q2N58PCG
					More data for this Ligand-Target Pair