MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01279346

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
VNL	4-HYDROXY-3-METHOXYBENZOATE	A,B,C,D	2AHC	0.73
VNL	4-HYDROXY-3-METHOXYBENZOATE	A	1XLR	0.73
AC6	P-HYDROXYACETOPHENONE	A	2GQ8	0.75
AC6	P-HYDROXYACETOPHENONE	X	2O48	0.75
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	B,C,D	2VK0	0.78
MPB	4-HYDROXY-BENZOIC ACID METHYL ESTER	A,B,D	3MTH	0.78
HBA	P-HYDROXYBENZALDEHYDE	A	1K03	0.77
HBA	P-HYDROXYBENZALDEHYDE	A,B	2VQ5	0.77
HBA	P-HYDROXYBENZALDEHYDE	A,B	1EB9	0.77
HBA	P-HYDROXYBENZALDEHYDE	A	2GQ9	0.77
HBA	P-HYDROXYBENZALDEHYDE	A,B	1Z42	0.77
HBA	P-HYDROXYBENZALDEHYDE	A	1OYB	0.77
FLN	2-PHENYL-4H-CHROMEN-4-ONE	A	2G0L	0.75
NAR	NARINGENIN	A,B	2UXU	0.71
NAR	NARINGENIN	A	2BRT	0.71
NAR	NARINGENIN	A	1CGK	0.71
NAR	NARINGENIN	A,B	1EYQ	0.71
1NH	(2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE	B	1O1S	0.7
V55	4-hydroxy-3-methoxybenzaldehyde	B,D,E,F	2VSS	0.8
V55	4-hydroxy-3-methoxybenzaldehyde	A,B,D,E,F	2VSU	0.8
BZM	BENZOIC ACID PHENYLMETHYLESTER	A,B	1DZM	0.72
FHB	3-FLUORO-4-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCF	0.73
MPP	3-(3,4-DIMETHOXYPHENYL)PROPIONIC ACID	A,B	2AY3	0.72
VXX	VANILLATE	A,B	1WB6	0.74
BVL	(2E)-1-[2-hydroxy-4-methoxy-5-(3- methylbut-2-en-1-yl)phenyl]-3-(4- hydroxyphenyl)prop-2-en-1-one	A	2ZBH	0.76
PSN	BENZYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4K	0.73
SAK	(2S)-5-hydroxy-2-(4-hydroxyphenyl)- 7-methoxy-2,3-dihydro-4H-chromen- 4-one	A,B,C,D,E,F	3D04	0.71
ZHZ	2-(4-METHOXYPHENYL)ACETAMIDE	D,H	2HKR	0.74
TOM	4-(2-METHOXYPHENYL)-2-OXOBUT-3- ENOIC ACID	A	2IMF	0.74
219	CYCLOHEXYLMETHYL 2-FORMYLPHENYL HYDROGEN PHOSPHATE	A	1O4I	0.72
DBA	(2,6-DIMETHYL-PHENOXY)-ACETIC ACID	A,B	1IDB	0.72
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE	B,C	1JX1	0.72
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE	A,B	1JX0	0.72
DFV	7-HYDROXY-2-(4-HYDROXY-PHENYL)- CHROMAN-4-ONE	A,B	1FM7	0.72
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID	A,B	2BXE	0.71
1FL	5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID	A,B	3D2T	0.71
BEK	2,3,5,6-TETRAFLUORO-4-METHOXY-BENZAMIDE	A	1KJR	0.74
SYR	SYRINGATE	A,B	1WB5	0.72
GEN	GENISTEIN	A	1QKM	0.74
GEN	GENISTEIN	A,B	1X7J	0.74
GEN	GENISTEIN	A,B	2QA8	0.74
GEN	GENISTEIN	A	1X7R	0.74
BHF	2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE	A	2HI4	0.71
ANN	4-METHOXYBENZOIC ACID	A	2B96	0.82
ANN	4-METHOXYBENZOIC ACID	A	2QUE	0.82
ANN	4-METHOXYBENZOIC ACID	A	1SV3	0.82
ANN	4-METHOXYBENZOIC ACID	A	1O2E	0.82
ANN	4-METHOXYBENZOIC ACID	A,B,C,D	3CBI	0.82
HMO	4'-HYDROXY-7-METHOXYISOFLAVONE	A	1FP2	0.74
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3GCL	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2QQT	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1TGM	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	2G5J	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	1OXR	0.75
AIN	2-(ACETYLOXY)BENZOIC ACID	A	3HWY	0.75
262	2-FORMYLPHENYL DIHYDROGEN PHOSPHATE	A	1O4D	0.73
ZZ1	4-METHYL-2H-CHROMEN-2-ONE	A	2CIP	0.7
DDC	7-HYDROXY-2-PHENYL-CHROMAN-4-ONE	A,B	1FM8	0.72
300	2-FORMYL-6-METHOXYPHENYL DIHYDROGEN PHOSPHATE	A	1O41	0.77
BZF	BENZOFURAN	A	182L	0.75
3MB	3-METHOXYBENZAMIDE	A	3PAX	0.74
DFL	2-(4-HYDROXY-PHENYL)-CHROMAN-4- ONE	A,B	1JEP	0.73
AI7	3-(heptyloxy)benzoic acid	A,B	2O3Z	0.77
QSO	5,7-dihydroxy-3-(4-methoxyphenyl)- 4H-chromen-4-one	A,B	2QYO	0.74
R71	[4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE	A	1W6J	0.71
R71	[4-({6-[ALLYL(METHYL)AMINO]HEXYL}OXY)- 2-FLUOROPHENYL](4-BROMOPHENYL)METHANONE	A,B,C	1GSZ	0.71
NPS	(2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid	A	2VDB	0.72
DBE	bis(4-hydroxyphenyl)methanone	A	2VKU	0.74
A04	5-[2-(TRIFLUOROMETHOXY)PHENYL]- 2-FUROIC ACID	A	2Q94	0.7
4MP	1-(4-METHOXYBENZOYL)-2-PYRROLIDINONE	A,B	2AL5	0.7
FC3	5-[2-(TRIFLUOROMETHYL)PHENYL]-2- FUROIC ACID	A	2EVC	0.71
PHB	P-HYDROXYBENZOIC ACID	A	1CJ4	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1DOB	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1PXB	0.72
PHB	P-HYDROXYBENZOIC ACID	A,B	1G1B	0.72
PHB	P-HYDROXYBENZOIC ACID	A,B	1YKJ	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1IUV	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1PBE	0.72
PHB	P-HYDROXYBENZOIC ACID	M,N,O,P,Q,R	3PCC	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1PDH	0.72
PHB	P-HYDROXYBENZOIC ACID	B	2BUW	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1CC4	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1CC6	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1IUW	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1FW9	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1G81	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1BGJ	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1IUX	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1CJ3	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1D7L	0.72
PHB	P-HYDROXYBENZOIC ACID	A	2PHH	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1BGN	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1PXA	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1DOC	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1K0I	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1BKW	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1JD3	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1PXC	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1TT8	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1CJ2	0.72
PHB	P-HYDROXYBENZOIC ACID	A,B	1Q4S	0.72
PHB	P-HYDROXYBENZOIC ACID	A	1BF3	0.72
PHB	P-HYDROXYBENZOIC ACID	B	2BUR	0.72
299	2,6-DIFORMYL-4-METHYLPHENYL DIHYDROGEN PHOSPHATE	A	1O4E	0.78
COU	COUMARIN	A	3CRB	0.7
COU	COUMARIN	A	2PMJ	0.7
COU	COUMARIN	A	2H90	0.7
COU	COUMARIN	A,B,C,D	1Z10	0.7
COU	COUMARIN	A	2PWB	0.7