MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01773221

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
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.74
IOY	P-IODO-D-PHENYLALANINE	A	1XBU	0.72
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.74
23F	(2Z)-2-AMINO-3-PHENYLACRYLIC ACID	A	1VRZ	0.71
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	1YYL	0.72
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	2I5Y	0.72
MEA	N-METHYLPHENYLALANINE	A	2PIL	0.71
MEA	N-METHYLPHENYLALANINE	A,B,C,D	1H0I	0.71
MEA	N-METHYLPHENYLALANINE	A,B,I	1DOJ	0.71
FTY	DEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINE	C,D	1A08	0.76
FTY	DEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINE	C,D,E,F	1QZ0	0.76
FTY	DEOXY-DIFLUOROMETHELENE-PHOSPHOTYROSINE	C,D,E,F	1XXV	0.76
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE- 1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2P1C	0.71
GG3	{1-HYDROXY-3-[METHYL(4-PHENYLBUTYL)AMINO]PROPANE- 1,1-DIYL}BIS(PHOSPHONIC ACID)	A,B	2Z7H	0.71
MFD	(2S,3S,8S,9S)-3-AMINO-9-METHOXY- 2,6,8-TRIMETHYL-10-PHENYLDECA-4,6- DIENOIC ACID	A	1AY3	0.71
BIR	N-[3-[(1-AMINOETHYL)(HYDROXY)PHOSPHORYL]- 2-(1,1'-BIPHENYL-4-YLMETHYL)PROPANOYL]ALANINE	A	1R1H	0.75
BIR	N-[3-[(1-AMINOETHYL)(HYDROXY)PHOSPHORYL]- 2-(1,1'-BIPHENYL-4-YLMETHYL)PROPANOYL]ALANINE	L	3B7R	0.75
PMI	(2-AMINO-2,3-DIHYDRO-1H-INDEN-2- YL)PHOSPHONIC ACID	A,B,C,D,E,F, G,H	2O7E	0.71
BDL	N-(biphenyl-4-ylsulfonyl)-D-leucine	A	3EHX	0.71
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.72
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.7
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.7
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.7
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.7
HCI	HYDROCINNAMIC ACID	A	1TOI	0.7
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.7
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.7
DPN	D-PHENYLALANINE	P	1MCS	0.74
DPN	D-PHENYLALANINE	A	1GOE	0.74
DPN	D-PHENYLALANINE	A	2RM9	0.74
DPN	D-PHENYLALANINE	A	1SOC	0.74
DPN	D-PHENYLALANINE	B,C,E,F	1SFQ	0.74
DPN	D-PHENYLALANINE	I	1ABJ	0.74
DPN	D-PHENYLALANINE	P	1DWE	0.74
DPN	D-PHENYLALANINE	I,M	1HLT	0.74
DPN	D-PHENYLALANINE	A,H,L	1J9C	0.74
DPN	D-PHENYLALANINE	I,T	1TMB	0.74
DPN	D-PHENYLALANINE	A	2JRY	0.74
DPN	D-PHENYLALANINE	A	2SOC	0.74
DPN	D-PHENYLALANINE	A	2YYF	0.74
DPN	D-PHENYLALANINE	I	2HGT	0.74
DPN	D-PHENYLALANINE	A,D	2Q3I	0.74
DPN	D-PHENYLALANINE	A,P	1MCD	0.74
DPN	D-PHENYLALANINE	P	1HAO	0.74
DPN	D-PHENYLALANINE	A,B,I	1Z8J	0.74
DPN	D-PHENYLALANINE	A,B,C	2PGQ	0.74
DPN	D-PHENYLALANINE	C,D,H,I,L,M, X,Y	1DVA	0.74
DPN	D-PHENYLALANINE	P	1NRR	0.74
DPN	D-PHENYLALANINE	I	1PPB	0.74
DPN	D-PHENYLALANINE	C,D,G,H	1NU7	0.74
DPN	D-PHENYLALANINE	I	2HPP	0.74
DPN	D-PHENYLALANINE	B,C	2OD3	0.74
DPN	D-PHENYLALANINE	A	1B0Q	0.74
DPN	D-PHENYLALANINE	B,C,E,F	1NU9	0.74
DPN	D-PHENYLALANINE	A,B,I	1Z8I	0.74
DPN	D-PHENYLALANINE	H,I,J	1TMU	0.74
DPN	D-PHENYLALANINE	A,B,C,D,E,F	2DNS	0.74
DPN	D-PHENYLALANINE	A	1GO9	0.74
DPN	D-PHENYLALANINE	B,C,E,F	1A0H	0.74
DPN	D-PHENYLALANINE	P	1MCF	0.74
DPN	D-PHENYLALANINE	A	2RME	0.74
DPN	D-PHENYLALANINE	H,I	1TMT	0.74
DPN	D-PHENYLALANINE	I	1ABI	0.74
DPN	D-PHENYLALANINE	R	1NRQ	0.74
DPN	D-PHENYLALANINE	B,C,F,G	2A1D	0.74
DPN	D-PHENYLALANINE	A,B	2Q33	0.74
DPN	D-PHENYLALANINE	C,H,L	1DAN	0.74
DPN	D-PHENYLALANINE	P	1MCE	0.74
DPN	D-PHENYLALANINE	B,C,E,F	2A45	0.74
DPN	D-PHENYLALANINE	A	2RMI	0.74
DPN	D-PHENYLALANINE	A,B,I	1TQ7	0.74
DPN	D-PHENYLALANINE	A	1W7M	0.74
DPN	D-PHENYLALANINE	P	1HAP	0.74
DPN	D-PHENYLALANINE	A,B	1ORF	0.74
DPN	D-PHENYLALANINE	I	1IHS	0.74
DPN	D-PHENYLALANINE	P	1MCC	0.74
DPN	D-PHENYLALANINE	A	2RMD	0.74
DPN	D-PHENYLALANINE	A	2JQB	0.74
DPN	D-PHENYLALANINE	I	2HPQ	0.74
DPN	D-PHENYLALANINE	C,E,F	1SHH	0.74
DPN	D-PHENYLALANINE	A,I	1CVR	0.74
DPN	D-PHENYLALANINE	L,P	1AUT	0.74
DPN	D-PHENYLALANINE	P	1MCI	0.74
DPN	D-PHENYLALANINE	H,I	3F6U	0.74
DPN	D-PHENYLALANINE	A	1BFW	0.74
DPN	D-PHENYLALANINE	H,I	1HAI	0.74
DPN	D-PHENYLALANINE	B,C	2THF	0.74
DPN	D-PHENYLALANINE	I	1IHT	0.74
DPN	D-PHENYLALANINE	A,P	1MCJ	0.74
DPN	D-PHENYLALANINE	A	1TKH	0.74
DPN	D-PHENYLALANINE	C,H,L,T	2FIR	0.74
DPN	D-PHENYLALANINE	A	2FMZ	0.74
DPN	D-PHENYLALANINE	A	1YL9	0.74
DPN	D-PHENYLALANINE	I	1HUT	0.74
DPN	D-PHENYLALANINE	I	1FXY	0.74
DPN	D-PHENYLALANINE	A	1YL8	0.74
DPN	D-PHENYLALANINE	C,H,L	1QFK	0.74
DPN	D-PHENYLALANINE	P	1MCB	0.74
0A9	methyl L-phenylalaninate	A	1AY2	0.7
0A9	methyl L-phenylalaninate	I	5ER1	0.7
0A9	methyl L-phenylalaninate	I,P	1HDT	0.7
BCS	BENZYLCYSTEINE	A,B,G,H	10GS	0.71
BCS	BENZYLCYSTEINE	A	1EH8	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.7
BEY	(2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]- 2-benzylpropanoic acid	A	3EBI	0.79
PTM	ALPHA-METHYL-O-PHOSPHOTYROSINE	H,L	1JYQ	0.73
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	A,L,M	3FEA	0.8
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	P	1CWD	0.8
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	L	3FE7	0.8
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	B	2GV2	0.8
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	B,D	1CWE	0.8
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.74
CXA	PHENYLALANINE-N-SULFONAMIDE	A	1IY7	0.72
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.71
1ZN	(2S,3S,4E,6E,8S,9S)-3-amino-9-methoxy- 2,6,8-trimethyl-10-phenyldeca-4,6- dienoic acid	C,F,M,N	2IAE	0.71
PH0	N-{(2S)-3-[(R)-[(1R)-1-amino-2- phenylethyl](hydroxy)phosphoryl]- 2-benzylpropanoyl}-L-phenylalanine	A	2R59	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.71
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.71
IGL	ALPHA-AMINO-2-INDANACETIC ACID	A	1BDK	0.72
PFF	4-FLUORO-L-PHENYLALANINE	A	3F3C	0.72
PFF	4-FLUORO-L-PHENYLALANINE	A,C,E,F	2UUE	0.72
PFF	4-FLUORO-L-PHENYLALANINE	A	1ZNT	0.72
PFF	4-FLUORO-L-PHENYLALANINE	F,H	1OL1	0.72
PFF	4-FLUORO-L-PHENYLALANINE	A,C,F,H	2C5V	0.72
PFF	4-FLUORO-L-PHENYLALANINE	E,F	1OL2	0.72
24I	(2S)-2-{[HYDROXY(4-IODOBENZYL)PHOSPHORYL]METHYL}PENTANEDIOIC ACID	A	2C6C	0.79
TFQ	4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE	A	3D6V	0.7
IBP	IBUPROFEN	A	3FKX	0.71
IBP	IBUPROFEN	A,B	2BXG	0.71
IBP	IBUPROFEN	A,B	1EQG	0.71
IBP	IBUPROFEN	A,B,C	2WD9	0.71
IBP	IBUPROFEN	A	2PWS	0.71
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.74
PHI	IODO-PHENYLALANINE	A	1TF9	0.72
PHI	IODO-PHENYLALANINE	A,B,C,D	1ORW	0.72
PHI	IODO-PHENYLALANINE	A	1T6H	0.72
PHI	IODO-PHENYLALANINE	A,B,C	1NLU	0.72
PHI	IODO-PHENYLALANINE	A,I	1GA1	0.72
PHI	IODO-PHENYLALANINE	A,I	1GA4	0.72
PHI	IODO-PHENYLALANINE	P	1CZI	0.72
ZAE	N-methyl-D-phenylalanine	H,I,R	1TBZ	0.71