BDBM236792 US9388149, 1 (Diastereoisomer 1)::US9388149, 1 (Diastereoisomer 2)::US9388149, 1 (Enantiomer 2 of diastereoisomer 2)

SMILES: CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O

InChI Key: InChIKey=VWSXKWXISJLOQM-UHFFFAOYSA-N

Data: 6 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 6 hits for monomerid = 236792   

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
C-X-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	244	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.08E+3	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	94	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	53	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	89	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair
C-X-C chemokine receptor type 1 (Homo sapiens (Human))	BDBM236792 (US9388149, 1 (Diastereoisomer 1) | US9388149, 1 (D...) Show SMILES CN(C)C(=O)c1cccc(Nc2c(NC(c3ccc(C)o3)C3(C)CCCO3)c(=O)c2=O)c1O Show InChI InChI=1S/C24H27N3O6/c1-13-9-10-16(33-13)22(24(2)11-6-12-32-24)26-18-17(20(29)21(18)30)25-15-8-5-7-14(19(15)28)23(31)27(3)4/h5,7-10,22,25-26,28H,6,11-12H2,1-4H3	PDB UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	819	n/a	n/a	n/a	n/a	n/a	37
GALDERMA RESEARCH & DEVELOPMENT US Patent					Assay Description ⿿PathHunter HEK293-CXCR2⿝ or ⿿U2OS hCXCR1 β-arrestin⿝ cells (DiscoveRx Corporation) were seeded overnight at 10 000 cells/well (384-well...				US Patent US9388149 (2016) BindingDB Entry DOI: 10.7270/Q26W990K
					More data for this Ligand-Target Pair