MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00599979

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
LEG	1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE	A,B	2PIN	0.71
DI5	AC-(D)PHE-PRO-BOROHOMOORNITHINE- OH	H	1LHG	0.7
HY1	PHENYLACETALDEHYDE	D,H	2I0S	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6Y	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6Z	0.73
HY1	PHENYLACETALDEHYDE	D,H	2OK4	0.73
HY1	PHENYLACETALDEHYDE	A,B	1D6U	0.73
S27	N-[[2-METHYL-4-HYDROXYCARBAMOYL]BUT- 4-YL-N]-BENZYL-P-[PHENYL]-P-[METHYL]PHOSPHINAMID	A,B	1B3D	0.7
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.72
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.72
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
LPF	1,1,1-TRIFLUORO-3-((N-ACETYL)-L- LEUCYLAMIDO)-4-PHENYL-BUTAN-2-ONE(N- ACETYL-L-LEUCYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	7GCH	0.71
PLH	METHYLAMINO-PHENYLALANYL-LEUCYL- HYDROXAMIC ACID	A	1HFC	0.77
PLH	METHYLAMINO-PHENYLALANYL-LEUCYL- HYDROXAMIC ACID	A	1MNC	0.77
0A9	methyl L-phenylalaninate	A	1AY2	0.73
0A9	methyl L-phenylalaninate	I	5ER1	0.73
0A9	methyl L-phenylalaninate	I,P	1HDT	0.73
1LP	TRANYLCYPROMINE	A,B	1OJB	0.76
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.8
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.8
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.8
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.73
I4B	ISOBUTYLBENZENE	A	184L	0.7
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.72
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.73
PCS	PHENYLALANYLMETHYLCHLORIDE	B,D	1DLK	0.72
PCS	PHENYLALANYLMETHYLCHLORIDE	A	1XQX	0.72
IGL	ALPHA-AMINO-2-INDANACETIC ACID	A	1BDK	0.71
FAF	2-ACETYLAMINO-4-METHYL-PENTANOIC ACID (1- FORMYL-2-PHENYL-ETHYL)-AMIDE	B,C	1GGD	0.72
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.73
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.73
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.73
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.73
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.73
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.73
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.73
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.73
AC0	1-PHENYLETHANONE	A	1ZK1	0.72
AC0	1-PHENYLETHANONE	A	1ZK4	0.72
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A	2AI7	0.72
SB7	[HYDROXY(3-PHENYLPROPYL)AMINO]METHANOL	A,B,C	2AI8	0.72
NFA	PHENYLALANINE AMIDE	A,B,C,D	2BTJ	0.81
NFA	PHENYLALANINE AMIDE	A,B,C,D,E,F	2EFX	0.81
NFA	PHENYLALANINE AMIDE	A,B,C,D	2VVJ	0.81
NFA	PHENYLALANINE AMIDE	A	2A4O	0.81
NFA	PHENYLALANINE AMIDE	A,B	1XAE	0.81
NFA	PHENYLALANINE AMIDE	A,B,C,D	2OGR	0.81
NFA	PHENYLALANINE AMIDE	A,B,C,D	1QA7	0.81
NFA	PHENYLALANINE AMIDE	A,B,C,D	2GW4	0.81
002	N-[(2R)-2-BENZYL-4-(HYDROXYAMINO)- 4-OXOBUTANOYL]-L-ISOLEUCYL-L-LEUCINE	A,B	2FV9	0.71
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.75
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
TFQ	4-(2,2,2-TRIFLUOROETHYL)-L-PHENYLALANINE	A	3D6V	0.71
PPT	3-(P-TOLYL)PROPIONIC ACID	A,B	2AY4	0.73
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
SGI	3-(4-hydroxyphenyl)propanamide	A,B	2R9K	0.71
23N	(2R)-2-benzyl-3-nitropropanoic acid	A	2RFH	0.75
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.71
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.73
IPO	PARA-IODO-D-PHENYLALANINE HYDROXAMIC ACID	A	1IGB	0.84
ZAE	N-methyl-D-phenylalanine	H,I,R	1TBZ	0.7
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.71
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.73
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.73
BP4	BIPHENYL-4-YL-ACETALDEHYDE	A,B,E,F,G,H	1MHW	0.7
MEA	N-METHYLPHENYLALANINE	A	2PIL	0.7
MEA	N-METHYLPHENYLALANINE	A,B,C,D	1H0I	0.7
MEA	N-METHYLPHENYLALANINE	A,B,I	1DOJ	0.7
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.82
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.76
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.76
IPP	(P-IODOPHENYLACETYLAMINO)METHYLPHOSPHINIC ACID	A,B	1BLS	0.76
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	1YYL	0.71
BIF	(R)-2-AMINO-3-(4-PHENYLCYCLOHEXYL)PROPANOIC ACID	G,M,P,S	2I5Y	0.71
BVA	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE	B,C	2P8O	0.79
KEL	N-[(2R)-2-benzyl-4-(hydroxyamino)- 4-oxobutanoyl]-L-alanine	X	3B7U	0.75
IOY	P-IODO-D-PHENYLALANINE	A	1XBU	0.71
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.7
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
NAM	NAM NAPTHYLAMINOALANINE	A,B,I,J	3FIV	0.74
NAM	NAM NAPTHYLAMINOALANINE	A,B,I,J	2FIV	0.74
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
BHO	BENZHYDROXAMIC ACID	A,B	1GX2	0.81
BHO	BENZHYDROXAMIC ACID	A	1HSR	0.81
BHO	BENZHYDROXAMIC ACID	A,B	2ATJ	0.81
BHO	BENZHYDROXAMIC ACID	A,B	4ATJ	0.81
BHO	BENZHYDROXAMIC ACID	A,B	3ATJ	0.81
BHO	BENZHYDROXAMIC ACID	A	3GCK	0.81
BHO	BENZHYDROXAMIC ACID	A,B,C,D,E,F, G,H	2BOY	0.81
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.73
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.73
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K5S	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1KEC	0.71
GRO	R-2-PHENYL-PROPRIONIC ACID	B	1K7D	0.71
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.75
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	B,C	1GG6	0.73
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	6GCH	0.73
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.73
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.73
PHA	PHENYLALANINAL	A,B	1OB2	0.77
PHA	PHENYLALANINAL	V,Y,Z	2WDG	0.77
PHA	PHENYLALANINAL	V,Y,Z	2WDK	0.77
PHA	PHENYLALANINAL	1,2,4,5,A,B, C,D,E,J,K,L, M,N,O,P,R,S, T,U,V,Z	1M90	0.77
PHA	PHENYLALANINAL	P	3SGA	0.77
PHA	PHENYLALANINAL	A,B,C,D,E,F	1OB5	0.77
PHA	PHENYLALANINAL	V,Y,Z	2WDM	0.77
PHA	PHENYLALANINAL	0,2,4,9,A,B, C,H,I,J,K,L, M,N,P,Q,R,S, T,X,Y,Z	1KQS	0.77
PHA	PHENYLALANINAL	A,B	1KDV	0.77
PHA	PHENYLALANINAL	1,2,4,5,6,A, B,C,D,E,J,K, L,M,N,O,P,R, S,T,U,V,Z	1Q86	0.77
PHA	PHENYLALANINAL	A,B	1KDY	0.77
PHA	PHENYLALANINAL	V,Y,Z	3FIC	0.77
PHA	PHENYLALANINAL	V,Y,Z	2WDH	0.77
PHA	PHENYLALANINAL	A,B	1KE2	0.77
GB5	(2E)-3-(4-CHLOROPHENYL)-N-HYDROXYACRYLAMIDE	A,B	2ILP	0.73
BIP	2-BENZYL-3-IODOPROPANOIC ACID	A,B,C,D	1BAV	0.71
3PL	3-PHENYLPROPANAL	E	1Y3G	0.74
GB4	(2E)-3-(2,4-DICHLOROPHENYL)-N-HYDROXYACRYLAMIDE	A,B	2IMA	0.7
TIO	(2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)- GLYCINE	E	1ZDP	0.72
1PA	PHENYLMETHYLACETIC ACID ALANINE	I	1BHF	0.71
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	A	1OS0	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	E,I	4TMN	0.7
PPH	[(1R)-1-amino-2-phenylethyl]phosphonic acid	S	1CGH	0.7
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.72
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.72