BDBM50104497 CHEMBL87116::Phosphoric acid 12-[(R)-2-[(R)-2-acetylamino-3-(1H-indol-2-yl)-propionylamino]-3-(1H-indol-3-yl)-propionylamino]-dodecyl ester 2-chloro-phenyl ester; compound with triethyl-amine

SMILES: CC(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCCCCCCCOP(O)(=O)Oc1ccccc1Cl

InChI Key: InChIKey=GBWBVQBXYASGEU-LJEWAXOPSA-N

Data: 1 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 1 hit for monomerid = 50104497   

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
Telomerase reverse transcriptase (Homo sapiens (Human))	BDBM50104497 (CHEMBL87116 | Phosphoric acid 12-[(R)-2-[(R)-2-ace...) Show SMILES CC(=O)N[C@H](Cc1cc2ccccc2[nH]1)C(=O)N[C@H](Cc1c[nH]c2ccccc12)C(=O)NCCCCCCCCCCCCOP(O)(=O)Oc1ccccc1Cl Show InChI InChI=1S/C42H53ClN5O7P/c1-30(49)46-39(28-33-26-31-18-10-13-21-36(31)47-33)42(51)48-38(27-32-29-45-37-22-14-11-19-34(32)37)41(50)44-24-16-8-6-4-2-3-5-7-9-17-25-54-56(52,53)55-40-23-15-12-20-35(40)43/h10-15,18-23,26,29,38-39,45,47H,2-9,16-17,24-25,27-28H2,1H3,(H,44,50)(H,46,49)(H,48,51)(H,52,53)/t38-,39-/m1/s1	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.29E+4	n/a	n/a	n/a	n/a	n/a	n/a
Kyushu University Curated by ChEMBL					Assay Description Inhibitory activity against telomerase extracted from HCT 116 cell lines				Bioorg Med Chem Lett 11: 2581-4 (2001) BindingDB Entry DOI: 10.7270/Q2XD10Z2
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