MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03413047

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
178	4-(4-HYDROXY-3-ISOPROPYLPHENYLTHIO)- 2-ISOPROPYLPHENOL	A,B	1TVE	0.75
BPZ	4,4'-cyclohexane-1,1-diyldiphenol	A	2ZKC	0.72
OBP		A,B	2DE3	0.85
BP7	1,1'-BIPHENYL-3,4-DIOL	A	2EI0	0.74
PIT	PICEATANNOL	A,B,C,D,E,F, G,H,I,J,K,L, M,N	2JJ1	0.72
369	5-(4-hydroxyphenoxy)-6-(3-hydroxyphenyl)- 7-methylnaphthalen-2-ol	A,B	3DT3	0.7
DIN	1,6-DIHYDROXY NAPHTHALENE	A	1ZB6	0.85
226	naphthalene-1,2,4,5,7-pentol	A,B	2NZ5	0.77
DES	DIETHYLSTILBESTROL	A,B,C,D	1S9P	0.73
DES	DIETHYLSTILBESTROL	A,B	3ERD	0.73
DES	DIETHYLSTILBESTROL	A,B	1TT6	0.73
DES	DIETHYLSTILBESTROL	A,B,C,D	1TZ8	0.73
D1N	NAPHTHALENE-1,2-DIOL	A	2EI1	0.79
2LP	2-ALLYLPHENOL	A	1OV5	0.71
LZ2	5-hydroxynaphthalene-1-sulfonamide	A	2VTH	0.88
ZTW	RALOXIFENE CORE	A,B	1GWQ	0.72
2MP	3,4-DIMETHYLPHENOL	A	1L5O	0.73
1NP	1-NAPHTHOL	X	2ZVQ	0.81
BPY	BIPHENYL-2,3-DIOL	A	1KMY	0.74
BPY	BIPHENYL-2,3-DIOL	B	1KW8	0.74
BPY	BIPHENYL-2,3-DIOL	A	2EI3	0.74
BPY	BIPHENYL-2,3-DIOL	A	1EIR	0.74
BPY	BIPHENYL-2,3-DIOL	B	1KW6	0.74
BPY	BIPHENYL-2,3-DIOL	B	1KWC	0.74
BPY	BIPHENYL-2,3-DIOL	B	1KW9	0.74
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2I	0.74
ETC	(R,R)-5,11-CIS-DIETHYL-5,6,11,12- TETRAHYDROCHRYSENE-2,8-DIOL	A,B	1L2J	0.74
IPB	5-METHYL-2-(1-METHYLETHYL)PHENOL	A,B	1E06	0.72
AZN	ALIZARIN RED	H,I,J,K,L,M, N,O	1OAR	0.75
ANF	ANTHRONE	H	2BJM	0.76
NAS	2-NAPHTHALENESULFONIC ACID	I	1QUR	0.71
NAS	2-NAPHTHALENESULFONIC ACID	E,I	1PPC	0.71
NAS	2-NAPHTHALENESULFONIC ACID	H	1ETS	0.71
STL	RESVERATROL	A,B	3CKL	0.74
STL	RESVERATROL	A,B,C,D	1U0W	0.74
STL	RESVERATROL	A	1CGZ	0.74
STL	RESVERATROL	A,B,C,D,E,F, G,H,I,J,K,L, M,N	2JIZ	0.74
STL	RESVERATROL	A	1Z1F	0.74
STL	RESVERATROL	A	1DVS	0.74
STL	RESVERATROL	A,B	1SG0	0.74
196	3-(3-FLUORO-4-HYDROXYPHENYL)-7- HYDROXY-1-NAPHTHONITRILE	A,B	1YYE	0.71
BIH	NAPHTHALENE-2,6-DISULFONIC ACID	A	1U4S	0.72
1OH	4-(1-methyl-1-phenylethyl)phenol	A	2ZAS	0.73
17M	17-METHYL-17-ALPHA-DIHYDROEQUILENIN	A,B	2B1Z	0.72
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2E2R	0.74
2OH	4,4'-PROPANE-2,2-DIYLDIPHENOL	A	2P7G	0.74
TN1	5,6,7,8-TETRAHYDRONAPHTHALEN-1- OL	A	1YSG	0.79
EYK	2-tert-butylbenzene-1,4-diol	D,F	3EYM	0.71
EYK	2-tert-butylbenzene-1,4-diol	B	3EYK	0.71
LJ1	2,6-dimethyl-4-[(E)-2-phenylethenyl]phenol	A,B	3CN0	0.7
HXS	4-[(1R,2S)-1-ethyl-2-(4-hydroxyphenyl)butyl]phenol	A,B	3CV6	0.74