BDBM639154 US20230391736, Example S-217622

SMILES: Cn1cc2cc(c(cc2n1)Cl)NC3=NC(=O)N(C(=O)N3Cc4cc(c(cc4F)F)F)Cc5ncn(n5)C

InChI Key: InChIKey=QMPBBNUOBOFBFS-UHFFFAOYSA-N

Data: 1 IC50

PDB links: 22 PDB IDs match this monomer.

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 13 hits for monomerid = 639154   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Replicase polyprotein 1a (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1a (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	18.9	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab [E3429V] (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.47E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1a [P3395H] (2019-nCoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (SARS-CoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1a (MERS-CoV)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.96E+6	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (HCoV-229E)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	5.63E+3	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (HCoV-OC43)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	134	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (HCoV-HKU1)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	44	n/a	n/a	n/a	n/a	n/a	n/a
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Replicase polyprotein 1ab (HCoV-NL63)	BDBM639154 (US20230391736, Example S-217622 | US20250025459, C...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	2.78E+4	n/a	n/a	n/a	n/a	n/a	n/a
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