BDBM50075183 1,4,5-Insp3::1D-myo-inositol 1,4,5-triphosphate::1D-myo-inositol 1,4,5-tris(dihydrogen phosphate)::1D-myo-inositol 1,4,5-trisphosphate::3,5,6-trioxyphosphate-1,2,4-cyclohexanetriol::CHEMBL279107::D-myo-inositol 1,4,5-trisphosphate::IP3::InsP3

SMILES: [C@H]1([C@@H]([C@H]([C@@H]([C@H]([C@@H]1OP(=O)(O)O)O)OP(=O)(O)O)OP(=O)(O)O)O)O

InChI Key: InChIKey=MMWCIQZXVOZEGG-UHFFFAOYSA-N

Data: 1 KI  11 IC50  8 Kd  10 EC50

PDB links: 59 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 30 hits for monomerid = 50075183   

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
Inositol-trisphosphate 3-kinase A (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	23	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	24.8	n/a	n/a	n/a	n/a
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Inactive phospholipase C-like protein 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inactive phospholipase C-like protein 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	0.210	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	2.32	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	12.5	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a
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Type 1 InsP3 receptor isoform S2 (Pig)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	300	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	24.8	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol-trisphosphate 3-kinase A (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.37E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol-trisphosphate 3-kinase A (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	6.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 2 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	52	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a
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Inositol 1,4,5-trisphosphate receptor type 3 (Bovine)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	1.40E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	126	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	126	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a
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					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 3 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	195	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	133	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	8.70	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	209	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	132	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 1 (Rat)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	n/a	n/a	209	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 2 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	4.40	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Inositol 1,4,5-trisphosphate receptor type 2 (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
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Inositol polyphosphate-5-phosphatase A (Human)	BDBM50075183 (1D-myo-inositol 1,4,5-tris(dihydrogen phosphate) |...) Show SMILES Show InChI	GoogleScholar	UniChem		1.50E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair