BDBM50186250 Adamantane-1-carboxylic acid ((S)-1-{3-[4-(2-methoxy-phenyl)-piperazin-1-yl]-propyl}-2,5-dioxo-pyrrolidin-3-yl)-amide::CHEMBL210107::N-[(3S)-1-{3-[4-(2-methoxyphenyl)piperazin-1-yl]propyl}-2,5-dioxopyrrolidin-3-yl]adamantane-1-carboxamide

SMILES: COc1ccccc1N1CCN(CCCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1

InChI Key: InChIKey=MSXFMUNHKYUABW-FJKIDYPQSA-N

Data: 2 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 2 hits for monomerid = 50186250   

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
5-hydroxytryptamine receptor 1A (Rattus norvegicus (rat))	BDBM50186250 (Adamantane-1-carboxylic acid ((S)-1-{3-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1 |r,TLB:26:27:25.24.30:31,THB:28:27:24:30.29.31,28:29:26.27.32:24,26:25:27.32.28:31| Show InChI InChI=1S/C29H40N4O4/c1-37-25-6-3-2-5-24(25)32-11-9-31(10-12-32)7-4-8-33-26(34)16-23(27(33)35)30-28(36)29-17-20-13-21(18-29)15-22(14-20)19-29/h2-3,5-6,20-23H,4,7-19H2,1H3,(H,30,36)/t20?,21?,22?,23-,29?/m0/s1	PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Jagiellonian University Medical College Curated by ChEMBL					Assay Description Displacement of [3H]8-OH-DPAT from 5HT1A receptor in rat hippocampal membrane				Eur J Med Chem 44: 800-8 (2009) Article DOI: 10.1016/j.ejmech.2008.05.021 BindingDB Entry DOI: 10.7270/Q20Z7468
					More data for this Ligand-Target Pair
5-hydroxytryptamine receptor 1A (Homo sapiens (Human))	BDBM50186250 (Adamantane-1-carboxylic acid ((S)-1-{3-[4-(2-metho...) Show SMILES COc1ccccc1N1CCN(CCCN2C(=O)C[C@H](NC(=O)C34CC5CC(CC(C5)C3)C4)C2=O)CC1 |r,TLB:26:27:25.24.30:31,THB:28:27:24:30.29.31,28:29:26.27.32:24,26:25:27.32.28:31| Show InChI InChI=1S/C29H40N4O4/c1-37-25-6-3-2-5-24(25)32-11-9-31(10-12-32)7-4-8-33-26(34)16-23(27(33)35)30-28(36)29-17-20-13-21(18-29)15-22(14-20)19-29/h2-3,5-6,20-23H,4,7-19H2,1H3,(H,30,36)/t20?,21?,22?,23-,29?/m0/s1	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	63	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Université Montpellier I et II Curated by ChEMBL					Assay Description Affinity for 5HT1A receptor				Bioorg Med Chem Lett 16: 3406-10 (2006) Article DOI: 10.1016/j.bmcl.2006.04.035 BindingDB Entry DOI: 10.7270/Q2542N6V
					More data for this Ligand-Target Pair