MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03039183

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
APA	AMIDO PHENYL PYRUVIC ACID	H,I	1AHT	0.7
APA	AMIDO PHENYL PYRUVIC ACID	A,B,C,D	1A0L	0.7
APA	AMIDO PHENYL PYRUVIC ACID	A	1TPP	0.7
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.73
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.73
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.73
FE3	4-(2-aminoethyl)-3-chlorobenzoic acid	A,B	2K1Q	0.79
NPG	N-SUCCINYL PHENYLGLYCINE	A,B,C,D	1SJD	0.71
CXA	PHENYLALANINE-N-SULFONAMIDE	A	1IY7	0.73
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	A,L,M	3FEA	0.71
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	P	1CWD	0.71
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	L	3FE7	0.71
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	B	2GV2	0.71
PM3	2-AMINO-3-(4-PHOSPHONOMETHYL-PHENYL)- PROPIONIC ACID	B,D	1CWE	0.71
MPQ	N-METHYL-ALPHA-PHENYL-GLYCINE	D	1D6E	0.77
ZAE	N-methyl-D-phenylalanine	H,I,R	1TBZ	0.73
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.75
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.77
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1W7Q	0.7
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H	1W7R	0.7
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.75
PAC	2-PHENYLACETIC ACID	B	1PNL	0.71
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.71
PAC	2-PHENYLACETIC ACID	B	1FXH	0.71
PAC	2-PHENYLACETIC ACID	A	2ISF	0.71
PAC	2-PHENYLACETIC ACID	A	2INE	0.71
IOY	P-IODO-D-PHENYLALANINE	A	1XBU	0.74
FCL	3-CHLORO-L-PHENYLALANINE	E,F	1OKW	0.85
CNT	N-METHYL-META-CHLORO-TYROSINE	C,D	1OKX	0.72
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IPW	0.79
2CL	(2,6-DICHLOROPHENYL)ACETIC ACID	A	2IS7	0.79
GHP	4-HYDROXYPHENYLGLYCINE	A	1DSR	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY5	0.75
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY8	0.75
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY9	0.75
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XXZ	0.75
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY4	0.75
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY6	0.75
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B,I,J	2FIV	0.72
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B	1B0H	0.72
ALN	NAPHTHALEN-2-YL-3-ALANINE	B	1FIV	0.72
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B,I,J	3FIV	0.72
4AF	4-ACETYL-L-PHENYLALANINE	A	1ZH6	0.74
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.73
0A9	methyl L-phenylalaninate	A	1AY2	0.72
0A9	methyl L-phenylalaninate	I	5ER1	0.72
0A9	methyl L-phenylalaninate	I,P	1HDT	0.72
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.78
APM	M-AMIDINOPHENYL-3-ALANINE	E	1PPH	0.73
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	1YYL	0.75
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	2I5Y	0.75
CHP	3-CHLORO-4-HYDROXYPHENYLGLYCINE	A	1DSR	0.76
BFL		A,B	1Q4G	0.7
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.81
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.81
3BZ	3-chlorobenzoate	X	2QVZ	0.71
3BZ	3-chlorobenzoate	X	2QVX	0.71
TFQ	4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE	A	3D6V	0.74
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.77
PHI	IODO-PHENYLALANINE	A	1TF9	0.74
PHI	IODO-PHENYLALANINE	A,B,C,D	1ORW	0.74
PHI	IODO-PHENYLALANINE	A	1T6H	0.74
PHI	IODO-PHENYLALANINE	A,B,C	1NLU	0.74
PHI	IODO-PHENYLALANINE	A,I	1GA1	0.74
PHI	IODO-PHENYLALANINE	A,I	1GA4	0.74
PHI	IODO-PHENYLALANINE	P	1CZI	0.74
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A	1DSR	0.7
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H	1W7R	0.7
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1W7Q	0.7
DPN	D-PHENYLALANINE	P	1MCS	0.76
DPN	D-PHENYLALANINE	A	1GOE	0.76
DPN	D-PHENYLALANINE	A	2RM9	0.76
DPN	D-PHENYLALANINE	A	1SOC	0.76
DPN	D-PHENYLALANINE	B,C,E,F	1SFQ	0.76
DPN	D-PHENYLALANINE	I	1ABJ	0.76
DPN	D-PHENYLALANINE	P	1DWE	0.76
DPN	D-PHENYLALANINE	I,M	1HLT	0.76
DPN	D-PHENYLALANINE	A,H,L	1J9C	0.76
DPN	D-PHENYLALANINE	I,T	1TMB	0.76
DPN	D-PHENYLALANINE	A	2JRY	0.76
DPN	D-PHENYLALANINE	A	2SOC	0.76
DPN	D-PHENYLALANINE	A	2YYF	0.76
DPN	D-PHENYLALANINE	I	2HGT	0.76
DPN	D-PHENYLALANINE	A,D	2Q3I	0.76
DPN	D-PHENYLALANINE	A,P	1MCD	0.76
DPN	D-PHENYLALANINE	P	1HAO	0.76
DPN	D-PHENYLALANINE	A,B,I	1Z8J	0.76
DPN	D-PHENYLALANINE	A,B,C	2PGQ	0.76
DPN	D-PHENYLALANINE	C,D,H,I,L,M, X,Y	1DVA	0.76
DPN	D-PHENYLALANINE	P	1NRR	0.76
DPN	D-PHENYLALANINE	I	1PPB	0.76
DPN	D-PHENYLALANINE	C,D,G,H	1NU7	0.76
DPN	D-PHENYLALANINE	I	2HPP	0.76
DPN	D-PHENYLALANINE	B,C	2OD3	0.76
DPN	D-PHENYLALANINE	A	1B0Q	0.76
DPN	D-PHENYLALANINE	B,C,E,F	1NU9	0.76
DPN	D-PHENYLALANINE	A,B,I	1Z8I	0.76
DPN	D-PHENYLALANINE	H,I,J	1TMU	0.76
DPN	D-PHENYLALANINE	A,B,C,D,E,F	2DNS	0.76
DPN	D-PHENYLALANINE	A	1GO9	0.76
DPN	D-PHENYLALANINE	B,C,E,F	1A0H	0.76
DPN	D-PHENYLALANINE	P	1MCF	0.76
DPN	D-PHENYLALANINE	A	2RME	0.76
DPN	D-PHENYLALANINE	H,I	1TMT	0.76
DPN	D-PHENYLALANINE	I	1ABI	0.76
DPN	D-PHENYLALANINE	R	1NRQ	0.76
DPN	D-PHENYLALANINE	B,C,F,G	2A1D	0.76
DPN	D-PHENYLALANINE	A,B	2Q33	0.76
DPN	D-PHENYLALANINE	C,H,L	1DAN	0.76
DPN	D-PHENYLALANINE	P	1MCE	0.76
DPN	D-PHENYLALANINE	B,C,E,F	2A45	0.76
DPN	D-PHENYLALANINE	A	2RMI	0.76
DPN	D-PHENYLALANINE	A,B,I	1TQ7	0.76
DPN	D-PHENYLALANINE	A	1W7M	0.76
DPN	D-PHENYLALANINE	P	1HAP	0.76
DPN	D-PHENYLALANINE	A,B	1ORF	0.76
DPN	D-PHENYLALANINE	I	1IHS	0.76
DPN	D-PHENYLALANINE	P	1MCC	0.76
DPN	D-PHENYLALANINE	A	2RMD	0.76
DPN	D-PHENYLALANINE	A	2JQB	0.76
DPN	D-PHENYLALANINE	I	2HPQ	0.76
DPN	D-PHENYLALANINE	C,E,F	1SHH	0.76
DPN	D-PHENYLALANINE	A,I	1CVR	0.76
DPN	D-PHENYLALANINE	L,P	1AUT	0.76
DPN	D-PHENYLALANINE	P	1MCI	0.76
DPN	D-PHENYLALANINE	H,I	3F6U	0.76
DPN	D-PHENYLALANINE	A	1BFW	0.76
DPN	D-PHENYLALANINE	H,I	1HAI	0.76
DPN	D-PHENYLALANINE	B,C	2THF	0.76
DPN	D-PHENYLALANINE	I	1IHT	0.76
DPN	D-PHENYLALANINE	A,P	1MCJ	0.76
DPN	D-PHENYLALANINE	A	1TKH	0.76
DPN	D-PHENYLALANINE	C,H,L,T	2FIR	0.76
DPN	D-PHENYLALANINE	A	2FMZ	0.76
DPN	D-PHENYLALANINE	A	1YL9	0.76
DPN	D-PHENYLALANINE	I	1HUT	0.76
DPN	D-PHENYLALANINE	I	1FXY	0.76
DPN	D-PHENYLALANINE	A	1YL8	0.76
DPN	D-PHENYLALANINE	C,H,L	1QFK	0.76
DPN	D-PHENYLALANINE	P	1MCB	0.76
MCG	(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINE	A,B	1ISS	0.79
PTM	ALPHA-METHYL-O-PHOSPHOTYROSINE	H,L	1JYQ	0.71
MEA	N-METHYLPHENYLALANINE	A	2PIL	0.73
MEA	N-METHYLPHENYLALANINE	A,B,C,D	1H0I	0.73
MEA	N-METHYLPHENYLALANINE	A,B,I	1DOJ	0.73
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,M,N	1FJM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVA	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1LCM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYM	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,I	2IE3	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,X,Y	2NPP	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVC	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,G,H	3DW8	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYL	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVD	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVB	0.7
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FR9	0.7
PBF	PARA-(BENZOYL)-PHENYLALANINE	A,B	1EEN	0.7
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2HGZ	0.7
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FRB	0.7
200	4-CHLORO-L-PHENYLALANINE	A,B	2AKW	0.83
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
APH	P-AMIDINOPHENYL-3-ALANINE	E,I	1PPC	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	H	1ETS	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	H	1ETT	0.73
APH	P-AMIDINOPHENYL-3-ALANINE	I	1QUR	0.73
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B	3CFQ	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1SV9	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	1NR6	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	3HWV	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	B	1DVX	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B6D	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A,B,C,D	1PXX	0.74
DIF	2-[2,6-DICHLOROPHENYL)AMINO]BENZENEACETIC ACID	A	2B17	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A	3F3C	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A,C,E,F	2UUE	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A	1ZNT	0.74
PFF	4-FLUORO-L-PHENYLALANINE	F,H	1OL1	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A,C,F,H	2C5V	0.74
PFF	4-FLUORO-L-PHENYLALANINE	E,F	1OL2	0.74
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2ITK	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	H,I	4THN	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2Q5A	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1ZWU	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1SKL	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	H,I	5GDS	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1ZH0	0.72
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2JT9	0.72
IGL	ALPHA-AMINO-2-INDANACETIC ACID	A	1BDK	0.73