MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03491971

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
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	0.7
IBP	IBUPROFEN	A	3FKX	0.73
IBP	IBUPROFEN	A,B	2BXG	0.73
IBP	IBUPROFEN	A,B	1EQG	0.73
IBP	IBUPROFEN	A,B,C	2WD9	0.73
IBP	IBUPROFEN	A	2PWS	0.73
SBX	1-CYCLOHEXYL-3-PHENYL-1-PROPYL- 1-(3,3-DIMETHYL-1,2-DIOXYPENTYL)- 2-PIPERIDINE CARBOXYLATE	A	1FKH	0.71
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
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.74
PFF	4-FLUORO-L-PHENYLALANINE	A	3F3C	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A,C,E,F	2UUE	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A	1ZNT	0.71
PFF	4-FLUORO-L-PHENYLALANINE	F,H	1OL1	0.71
PFF	4-FLUORO-L-PHENYLALANINE	A,C,F,H	2C5V	0.71
PFF	4-FLUORO-L-PHENYLALANINE	E,F	1OL2	0.71
791	2-PHENYLMALONIC ACID	A	1O4P	0.72
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.73
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.72
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.73
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY5	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY8	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY9	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XXZ	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY4	0.7
IAM	4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINE	A	1XY6	0.7
PPY	3-PHENYLPYRUVIC ACID	A,B	2Q5O	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B	1LCO	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B,C,D,E,F	2ZF4	0.72
PPY	3-PHENYLPYRUVIC ACID	A,B	1BW9	0.72
IGL	ALPHA-AMINO-2-INDANACETIC ACID	A	1BDK	0.71
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.72
OIN	(1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE	A	1TH6	0.7
OIN	(1R,5S)-8-METHYL-8-AZABICYCLO[3.2.1]OCT- 3-YL (2R)-3-HYDROXY-2-PHENYLPROPANOATE	A	2ARM	0.7
ZAE	N-methyl-D-phenylalanine	H,I,R	1TBZ	0.72
23N	(2R)-2-benzyl-3-nitropropanoic acid	A	2RFH	0.74
PHI	IODO-PHENYLALANINE	A	1TF9	0.71
PHI	IODO-PHENYLALANINE	A,B,C,D	1ORW	0.71
PHI	IODO-PHENYLALANINE	A	1T6H	0.71
PHI	IODO-PHENYLALANINE	A,B,C	1NLU	0.71
PHI	IODO-PHENYLALANINE	A,I	1GA1	0.71
PHI	IODO-PHENYLALANINE	A,I	1GA4	0.71
PHI	IODO-PHENYLALANINE	P	1CZI	0.71
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	1YYL	0.74
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	2I5Y	0.74
BZS	L-BENZYLSUCCINIC ACID	A	1CBX	0.71
BZS	L-BENZYLSUCCINIC ACID	A	1HYT	0.71
BZS	L-BENZYLSUCCINIC ACID	A,B	1WHT	0.71
KPV	5-PHENYL-2-KETO-VALERIC ACID	A,B	2Q5Q	0.72
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B,I,J	2FIV	0.7
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B	1B0H	0.7
ALN	NAPHTHALEN-2-YL-3-ALANINE	B	1FIV	0.7
ALN	NAPHTHALEN-2-YL-3-ALANINE	A,B,I,J	3FIV	0.7
TFQ	4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE	A	3D6V	0.71
FOG	(4S,5S)-5-amino-4-hydroxy-6-phenylhexanoic acid	I	1EED	0.7
DPN	D-PHENYLALANINE	P	1MCS	0.73
DPN	D-PHENYLALANINE	A	1GOE	0.73
DPN	D-PHENYLALANINE	A	2RM9	0.73
DPN	D-PHENYLALANINE	A	1SOC	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1SFQ	0.73
DPN	D-PHENYLALANINE	I	1ABJ	0.73
DPN	D-PHENYLALANINE	P	1DWE	0.73
DPN	D-PHENYLALANINE	I,M	1HLT	0.73
DPN	D-PHENYLALANINE	A,H,L	1J9C	0.73
DPN	D-PHENYLALANINE	I,T	1TMB	0.73
DPN	D-PHENYLALANINE	A	2JRY	0.73
DPN	D-PHENYLALANINE	A	2SOC	0.73
DPN	D-PHENYLALANINE	A	2YYF	0.73
DPN	D-PHENYLALANINE	I	2HGT	0.73
DPN	D-PHENYLALANINE	A,D	2Q3I	0.73
DPN	D-PHENYLALANINE	A,P	1MCD	0.73
DPN	D-PHENYLALANINE	P	1HAO	0.73
DPN	D-PHENYLALANINE	A,B,I	1Z8J	0.73
DPN	D-PHENYLALANINE	A,B,C	2PGQ	0.73
DPN	D-PHENYLALANINE	C,D,H,I,L,M, X,Y	1DVA	0.73
DPN	D-PHENYLALANINE	P	1NRR	0.73
DPN	D-PHENYLALANINE	I	1PPB	0.73
DPN	D-PHENYLALANINE	C,D,G,H	1NU7	0.73
DPN	D-PHENYLALANINE	I	2HPP	0.73
DPN	D-PHENYLALANINE	B,C	2OD3	0.73
DPN	D-PHENYLALANINE	A	1B0Q	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1NU9	0.73
DPN	D-PHENYLALANINE	A,B,I	1Z8I	0.73
DPN	D-PHENYLALANINE	H,I,J	1TMU	0.73
DPN	D-PHENYLALANINE	A,B,C,D,E,F	2DNS	0.73
DPN	D-PHENYLALANINE	A	1GO9	0.73
DPN	D-PHENYLALANINE	B,C,E,F	1A0H	0.73
DPN	D-PHENYLALANINE	P	1MCF	0.73
DPN	D-PHENYLALANINE	A	2RME	0.73
DPN	D-PHENYLALANINE	H,I	1TMT	0.73
DPN	D-PHENYLALANINE	I	1ABI	0.73
DPN	D-PHENYLALANINE	R	1NRQ	0.73
DPN	D-PHENYLALANINE	B,C,F,G	2A1D	0.73
DPN	D-PHENYLALANINE	A,B	2Q33	0.73
DPN	D-PHENYLALANINE	C,H,L	1DAN	0.73
DPN	D-PHENYLALANINE	P	1MCE	0.73
DPN	D-PHENYLALANINE	B,C,E,F	2A45	0.73
DPN	D-PHENYLALANINE	A	2RMI	0.73
DPN	D-PHENYLALANINE	A,B,I	1TQ7	0.73
DPN	D-PHENYLALANINE	A	1W7M	0.73
DPN	D-PHENYLALANINE	P	1HAP	0.73
DPN	D-PHENYLALANINE	A,B	1ORF	0.73
DPN	D-PHENYLALANINE	I	1IHS	0.73
DPN	D-PHENYLALANINE	P	1MCC	0.73
DPN	D-PHENYLALANINE	A	2RMD	0.73
DPN	D-PHENYLALANINE	A	2JQB	0.73
DPN	D-PHENYLALANINE	I	2HPQ	0.73
DPN	D-PHENYLALANINE	C,E,F	1SHH	0.73
DPN	D-PHENYLALANINE	A,I	1CVR	0.73
DPN	D-PHENYLALANINE	L,P	1AUT	0.73
DPN	D-PHENYLALANINE	P	1MCI	0.73
DPN	D-PHENYLALANINE	H,I	3F6U	0.73
DPN	D-PHENYLALANINE	A	1BFW	0.73
DPN	D-PHENYLALANINE	H,I	1HAI	0.73
DPN	D-PHENYLALANINE	B,C	2THF	0.73
DPN	D-PHENYLALANINE	I	1IHT	0.73
DPN	D-PHENYLALANINE	A,P	1MCJ	0.73
DPN	D-PHENYLALANINE	A	1TKH	0.73
DPN	D-PHENYLALANINE	C,H,L,T	2FIR	0.73
DPN	D-PHENYLALANINE	A	2FMZ	0.73
DPN	D-PHENYLALANINE	A	1YL9	0.73
DPN	D-PHENYLALANINE	I	1HUT	0.73
DPN	D-PHENYLALANINE	I	1FXY	0.73
DPN	D-PHENYLALANINE	A	1YL8	0.73
DPN	D-PHENYLALANINE	C,H,L	1QFK	0.73
DPN	D-PHENYLALANINE	P	1MCB	0.73
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.74
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.74
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.74
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.74
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.74
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.74
CLT	4-PHENYL-BUTANOIC ACID	A	1THL	0.7
CLT	4-PHENYL-BUTANOIC ACID	A,B	2AY7	0.7
CLT	4-PHENYL-BUTANOIC ACID	E,I	1TMN	0.7
4AF	4-ACETYL-L-PHENYLALANINE	A	1ZH6	0.74
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.74
NHL	(4S)-4-(2-NAPHTHYLMETHYL)-D-GLUTAMIC ACID	A	2OHV	0.71
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FR9	0.75
PBF	PARA-(BENZOYL)-PHENYLALANINE	A,B	1EEN	0.75
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2HGZ	0.75
PBF	PARA-(BENZOYL)-PHENYLALANINE	A	2FRB	0.75
PG9	D-PHENYLGLYCINE	A,B,G,H	10GS	0.71
PG9	D-PHENYLGLYCINE	A,B,C,D	2B4K	0.71
APA	AMIDO PHENYL PYRUVIC ACID	H,I	1AHT	0.71
APA	AMIDO PHENYL PYRUVIC ACID	A,B,C,D	1A0L	0.71
APA	AMIDO PHENYL PYRUVIC ACID	A	1TPP	0.71
BEY	(2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]- 2-benzylpropanoic acid	A	3EBI	0.75
BR4	6-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)- HEXANOIC ACID	A	1KQU	0.73
1TY	3-{(3E)-4-HYDROXY-6-OXO-3-[(2-PHENYLETHYL)IMINO]CYCLOHEXA- 1,4-DIEN-1-YL}ALANINE	A,B	2CWU	0.75
FLP	FLURBIPROFEN	A,B,C,D	3PGH	0.71
FLP	FLURBIPROFEN	A,B	1CQE	0.71
FLP	FLURBIPROFEN	A,B	1EQH	0.71
FLP	FLURBIPROFEN	A,B	2AYL	0.71
FLP	FLURBIPROFEN	A	1DVT	0.71
FLP	FLURBIPROFEN	A	1R9O	0.71
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.73
MEA	N-METHYLPHENYLALANINE	A	2PIL	0.72
MEA	N-METHYLPHENYLALANINE	A,B,C,D	1H0I	0.72
MEA	N-METHYLPHENYLALANINE	A,B,I	1DOJ	0.72
FRF	PHE-REDUCED-PHE	A,I	1GVX	0.71
TYT	TYROSINE DERIVATIVE	A,B	1LVN	0.77
MFD	(2S,3S,8S,9S)-3-AMINO-9-METHOXY- 2,6,8-TRIMETHYL-10-PHENYLDECA-4,6- DIENOIC ACID	A	1AY3	0.7
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,M,N	1FJM	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVA	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1LCM	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYM	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,I	2IE3	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,X,Y	2NPP	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVC	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	C,F,G,H	3DW8	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A,B,C,D,E,F, G,H	2NYL	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVD	0.74
ADD	2,6,8-TRIMETHYL-3-AMINO-9-BENZYL- 9-METHOXYNONANOIC ACID	A	1EVB	0.74
IOY	P-IODO-D-PHENYLALANINE	A	1XBU	0.71
PAC	2-PHENYLACETIC ACID	B	1PNL	0.7
PAC	2-PHENYLACETIC ACID	B	1K5Q	0.7
PAC	2-PHENYLACETIC ACID	B	1FXH	0.7
PAC	2-PHENYLACETIC ACID	A	2ISF	0.7
PAC	2-PHENYLACETIC ACID	A	2INE	0.7
BFL		A,B	1Q4G	0.73
CXA	PHENYLALANINE-N-SULFONAMIDE	A	1IY7	0.71
HCI	HYDROCINNAMIC ACID	A,B	1BXG	0.71
HCI	HYDROCINNAMIC ACID	A,B	1TOG	0.71
HCI	HYDROCINNAMIC ACID	A,B	1V2F	0.71
HCI	HYDROCINNAMIC ACID	A,B	1AHX	0.71
HCI	HYDROCINNAMIC ACID	A	1TOI	0.71
HCI	HYDROCINNAMIC ACID	A,B	1AY8	0.71
HCI	HYDROCINNAMIC ACID	A	1TOJ	0.71
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2ITK	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	H,I	4THN	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2Q5A	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1ZWU	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1SKL	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	H,I	5GDS	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	A	1ZH0	0.7
NAL	BETA-(2-NAPHTHYL)-ALANINE	A,B	2JT9	0.7
TCQ	3-((3E)-4-(HYDROXYMETHYL)-6-OXO- 3-{[(1S,2R)-2-PHENYLCYCLOPROPYL]IMINO}CYCLOHEXA- 1,4-DIEN-1-YL)ALANINE	A,B	1W4N	0.74
ELI	6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID	A,B	2GH5	0.72
BIP	2-BENZYL-3-IODOPROPANOIC ACID	A,B,C,D	1BAV	0.71
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.74