BDBM323483 (1,2-Trans)-2-((3-(3-Aminopropyl)Phenoxy)Methyl)Cyclohexanol::US10188615, Example 148::US10639286, Example 148

SMILES: NCCCc1cccc(OC[C@@H]2CCCC[C@H]2O)c1

InChI Key: InChIKey=XNGXSQKPYOBCNP-GOEBONIOSA-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 = 323483   

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
Retinaldehyde-binding protein 1 (Homo sapiens (Human))	BDBM323483 ((1,2-Trans)-2-((3-(3-Aminopropyl)Phenoxy)Methyl)Cy...) Show SMILES NCCCc1cccc(OC[C@@H]2CCCC[C@H]2O)c1 |r| Show InChI InChI=1S/C16H25NO2/c17-10-4-6-13-5-3-8-15(11-13)19-12-14-7-1-2-9-16(14)18/h3,5,8,11,14,16,18H,1-2,4,6-7,9-10,12,17H2/t14-,16+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
ACUCELA INC. US Patent					Assay Description Isomerase inhibition reactions were performed essentially as described (Stecher et al., J Biol. Chem. 274:8577-85 (1999).				US Patent US10639286 (2020)
					More data for this Ligand-Target Pair
Retinoid isomerohydrolase (Homo sapiens (Human))	BDBM323483 ((1,2-Trans)-2-((3-(3-Aminopropyl)Phenoxy)Methyl)Cy...) Show SMILES NCCCc1cccc(OC[C@@H]2CCCC[C@H]2O)c1 |r| Show InChI InChI=1S/C16H25NO2/c17-10-4-6-13-5-3-8-15(11-13)19-12-14-7-1-2-9-16(14)18/h3,5,8,11,14,16,18H,1-2,4,6-7,9-10,12,17H2/t14-,16+/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
ACUCELA INC. US Patent					Assay Description Isomerase inhibition reactions were performed essentially as described (Stecher et al., J. Biol. Chem. 274:8577-85 (1999); see also Golczak et al., P...				US Patent US10188615 (2019) BindingDB Entry DOI: 10.7270/Q2NP26HC
					More data for this Ligand-Target Pair