BDBM36071 (1R,2R)-trans-1,2-cyclohexanediol::trans-(1R(S),2R(S))-cyclohexane-1,2-diol (10)

SMILES: C1CC[C@H]([C@@H](C1)O)O

InChI Key: InChIKey=PFURGBBHAOXLIO-UHFFFAOYSA-N

Data: 8 KI  1 ITC

PDB links: 2 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 8 hits for monomerid = 36071   

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
Carbonic anhydrase 3 (Bovine)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		4.28E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
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Carbonic anhydrase 2 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		4.68E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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					More data for this Ligand-Target Pair
Carbonic anhydrase 2 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		4.72E+3	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 4 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		1.88E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 6 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		7.62E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Carbonic anhydrase 6 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		7.62E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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Carbonic anhydrase 1 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
TBA									Citation and Details
					More data for this Ligand-Target Pair
Carbonic anhydrase 1 (Human)	BDBM36071 ((1R,2R)-trans-1,2-cyclohexanediol | trans-(1R(S),2...) Show SMILES Show InChI	GoogleScholar	UniChem		1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a	7.4	n/a
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					More data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 36071

Cell (A)	Syringe (B)	Cell Links	Syringe Links	Cell + Syr Links	ΔG° kcal/mole	-TΔS° kcal/mole	ΔH° kcal/mole	log K	pH	Temp °C
BDBM11	BDBM36071				-2.63	-1.68	-0.951	1.93	6.90	25
TBA					Details of this binding reaction