BDBM5 cyclohexanol::cyclohexanol-d12

SMILES: OC1CCCCC1

InChI Key: InChIKey=HPXRVTGHNJAIIH-UHFFFAOYSA-N

Data: 30 ITC

PDB links: 2 PDB IDs match this monomer. 396 PDB IDs contain this monomer as substructures. 396 PDB IDs contain inhibitors having a similarity of 90% to 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 -- ITC Data from BindingDB

Found 30 hits for monomerid = 5

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
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.48	-0.138	-2.39	1.89	6.90	14.9
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.51	0.211	-2.68	1.86	6.90	20.7
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.44	0.640	-3.06	1.79	6.90	24.8
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.41	0.783	-3.18	1.76	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.44	0.869	-3.30	1.76	6.90	29.9
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM4	BDBM5	CHEBI MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-2.39	1.25	-3.68	1.70	6.90	35.1
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.87	-2.66	-1.17	2.89	6.90	20
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.87	-2.28	-1.60	2.86	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.89	-2.35	-1.58	2.85	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.92	-2.35	-1.55	2.86	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.87	-2.28	-1.60	2.84	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.89	-2.35	-1.58	2.85	6.90	25
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.94	-2.03	-1.96	2.84	6.90	30
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.92	-1.62	-2.36	2.78	6.90	35
National Institute of Standards and Technology					J Phys Chem 98: 4098-4103 (1994)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.88	-2.36	-1.50	2.85	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 122: 4418-35 (2000)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.85	-3.17	-0.680	2.93	6.90	14.5
NIH					Biophys J 71: 2144-54 (1996)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.87	-2.33	-1.55	2.84	6.90	25
NIH					Biophys J 71: 2144-54 (1996)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.91	-1.58	-2.34	2.77	6.90	35
NIH					Biophys J 71: 2144-54 (1996)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.95	-0.859	-3.10	2.71	6.90	45
NIH					Biophys J 71: 2144-54 (1996)
BDBM36127	BDBM5	CHEBI PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.68	-2.29	-1.38	2.70	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 813-26 (2002)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.88	-2.36	-1.50	2.85	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.92	-2.49	-1.43	2.87	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.81	-2.34	-1.48	2.80	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.87	-2.54	-1.33	2.84	6.90	25
Japan Science and Technology Agency					J Am Chem Soc 124: 12361-71 (2002)
BDBM11	BDBM5	CHEBI KEGG MMDB PC cid PC sid PDB	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.88	-2.44	-1.45	2.85	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36267	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-3.98	-2.54	-1.45	2.92	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36268	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-4.07	-3.60	-0.480	2.98	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36269	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-4.31	-3.49	-0.822	3.16	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36270	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-4.38	-3.56	-0.822	3.21	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)
BDBM36271	BDBM5	PC cid PC sid	CHEBI DrugBank KEGG MMDB PC cid PC sid PDB		-4.22	-2.83	-1.39	3.10	7.20	25
Nankai University					J Org Chem 69: 173-80 (2004)