BDBM50495682 CHEMBL3115095

SMILES: O=C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N(Cc1ccccc1)N1CCCCC1

InChI Key: InChIKey=OMQRFBWBVMUDMD-NDEPHWFRSA-N

Data: 3 KI

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 = 50495682   

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
Protease (Human immunodeficiency virus 1 (HIV-1))	BDBM50495682 (CHEMBL3115095) Show SMILES O=C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N(Cc1ccccc1)N1CCCCC1 |r| Show InChI InChI=1S/C29H33N3O2/c33-24-28(21-25-13-5-1-6-14-25)31(22-26-15-7-2-8-16-26)29(34)32(30-19-11-4-12-20-30)23-27-17-9-3-10-18-27/h1-3,5-10,13-18,24,28H,4,11-12,19-23H2/t28-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	4.63E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lyon - ENS Curated by ChEMBL					Assay Description Inhibition of HIV-1 recombinant protease using DABCYL-GABA-Ser-Asn-Tyr-Pro-Ile-Val-Gln-EDANS as substrate incubated for 30 mins prior to substrate ad...				Bioorg Med Chem 21: 5407-13 (2013) Article DOI: 10.1016/j.bmc.2013.06.018 BindingDB Entry DOI: 10.7270/Q2D50QXV
					More data for this Ligand-Target Pair
Protease (Human immunodeficiency virus 1 (HIV-1))	BDBM50495682 (CHEMBL3115095) Show SMILES O=C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N(Cc1ccccc1)N1CCCCC1 |r| Show InChI InChI=1S/C29H33N3O2/c33-24-28(21-25-13-5-1-6-14-25)31(22-26-15-7-2-8-16-26)29(34)32(30-19-11-4-12-20-30)23-27-17-9-3-10-18-27/h1-3,5-10,13-18,24,28H,4,11-12,19-23H2/t28-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	9.93E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lyon - ENS Curated by ChEMBL					Assay Description Inhibition of HIV-1 recombinant protease using DABCYL-GABA-Ser-Asn-Tyr-Pro-Ile-Val-Gln-EDANS as substrate incubated for 30 mins prior to substrate ad...				Bioorg Med Chem 21: 5407-13 (2013) Article DOI: 10.1016/j.bmc.2013.06.018 BindingDB Entry DOI: 10.7270/Q2D50QXV
					More data for this Ligand-Target Pair
Protease (Human immunodeficiency virus 1 (HIV-1))	BDBM50495682 (CHEMBL3115095) Show SMILES O=C[C@H](Cc1ccccc1)N(Cc1ccccc1)C(=O)N(Cc1ccccc1)N1CCCCC1 |r| Show InChI InChI=1S/C29H33N3O2/c33-24-28(21-25-13-5-1-6-14-25)31(22-26-15-7-2-8-16-26)29(34)32(30-19-11-4-12-20-30)23-27-17-9-3-10-18-27/h1-3,5-10,13-18,24,28H,4,11-12,19-23H2/t28-/m0/s1	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.12E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ de Lyon - ENS Curated by ChEMBL					Assay Description Inhibition of HIV-1 recombinant protease using DABCYL-GABA-Ser-Asn-Tyr-Pro-Ile-Val-Gln-EDANS as substrate incubated for 30 mins prior to substrate ad...				Bioorg Med Chem 21: 5407-13 (2013) Article DOI: 10.1016/j.bmc.2013.06.018 BindingDB Entry DOI: 10.7270/Q2D50QXV
					More data for this Ligand-Target Pair