MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02318274

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
BHO	BENZHYDROXAMIC ACID	A,B	1GX2	0.73
BHO	BENZHYDROXAMIC ACID	A	1HSR	0.73
BHO	BENZHYDROXAMIC ACID	A,B	2ATJ	0.73
BHO	BENZHYDROXAMIC ACID	A,B	4ATJ	0.73
BHO	BENZHYDROXAMIC ACID	A,B	3ATJ	0.73
BHO	BENZHYDROXAMIC ACID	A	3GCK	0.73
BHO	BENZHYDROXAMIC ACID	A,B,C,D,E,F, G,H	2BOY	0.73
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	B,C	1GG6	0.71
APF	1,1,1-TRIFLUORO-3-ACETAMIDO-4-PHENYL BUTAN- 2-ONE(N-ACETYL-L-PHENYLALANYL TRIFLUOROMETHYL KETONE)	G	6GCH	0.71
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
DPH	DEAMINO-METHYL-PHENYLALANINE	A	1OS0	0.7
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJI	0.7
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2JJJ	0.7
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	2VS2	0.7
DPH	DEAMINO-METHYL-PHENYLALANINE	A,B	1OD1	0.7
DPH	DEAMINO-METHYL-PHENYLALANINE	E	1EPR	0.7
HY1	PHENYLACETALDEHYDE	D,H	2I0S	0.75
HY1	PHENYLACETALDEHYDE	A,B	1D6Y	0.75
HY1	PHENYLACETALDEHYDE	A,B	1D6Z	0.75
HY1	PHENYLACETALDEHYDE	D,H	2OK4	0.75
HY1	PHENYLACETALDEHYDE	A,B	1D6U	0.75
APD	3-METHYLPHENYLALANINE	A,B,C	1GMY	0.71
3PL	3-PHENYLPROPANAL	E	1Y3G	0.76
5PV	5-PHENYLVALERIC ACID	A,B	2AY9	0.7
PEA	2-PHENYLETHYLAMINE	A,B,E,F,G,H	1MHW	0.74
PEA	2-PHENYLETHYLAMINE	A	1TNJ	0.74
PEA	2-PHENYLETHYLAMINE	D,H	2HKM	0.74
PEA	2-PHENYLETHYLAMINE	A	1UTO	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6Y	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6Z	0.74
PEA	2-PHENYLETHYLAMINE	A,B	1D6U	0.74
PEA	2-PHENYLETHYLAMINE	A	1UTM	0.74
SRB	L-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	3VGC	0.72
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.8
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.8
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.8
NAM	NAM NAPTHYLAMINOALANINE	A,B,I,J	3FIV	0.81
NAM	NAM NAPTHYLAMINOALANINE	A,B,I,J	2FIV	0.81
9TA	1,4-BIS-[2-(2-HYDROXY-ETHYLAMINO)- ETHYLAMINO]-ANTHRAQUINONE	A,B	1FDG	0.7
IGL	ALPHA-AMINO-2-INDANACETIC ACID	A	1BDK	0.71
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.74
FAF	2-ACETYLAMINO-4-METHYL-PENTANOIC ACID (1- FORMYL-2-PHENYL-ETHYL)-AMIDE	B,C	1GGD	0.72
HBC	(2-AMINO-3-PHENYL-BICYCLO[2.2.1]HEPT- 2-YL)-PHENYL-METHANONE	H	1JGU	0.78
4FP	4-(4-FLUOROBENZYL)PIPERIDINE	A	2OHN	0.71
PQN	PHYLLOQUINONE	A,B,C,F,I,J, K,L,M,X	1JB0	0.71
PQN	PHYLLOQUINONE	1,2,3,4,A,B, C,F,G,H,I,J, K,L	2O01	0.71
PQN	PHYLLOQUINONE	A,B,C,F,K,L	2PPS	0.71
PQN	PHYLLOQUINONE	A,B,C,F,K,L	1C51	0.71
PQN	PHYLLOQUINONE	0,1,2,3,4,5, 6,7,8,9,A,B, C,F,G,H,J,K, L,P,Q,R,U,V, W,Z	1QZV	0.71
NFA	PHENYLALANINE AMIDE	A,B,C,D	2BTJ	0.83
NFA	PHENYLALANINE AMIDE	A,B,C,D,E,F	2EFX	0.83
NFA	PHENYLALANINE AMIDE	A,B,C,D	2VVJ	0.83
NFA	PHENYLALANINE AMIDE	A	2A4O	0.83
NFA	PHENYLALANINE AMIDE	A,B	1XAE	0.83
NFA	PHENYLALANINE AMIDE	A,B,C,D	2OGR	0.83
NFA	PHENYLALANINE AMIDE	A,B,C,D	1QA7	0.83
NFA	PHENYLALANINE AMIDE	A,B,C,D	2GW4	0.83
BR4	6-PHENYL-4(R)-(7-PHENYL-HEPTANOYLAMINO)- HEXANOIC ACID	A	1KQU	0.71
MIN	METHYL-PHE-PRO-AMINO-CYCLOHEXYLGLYCINE	H,I	1TOM	0.72
JNH	1-[2-(S)-AMINO-3-BIPHENYL-4-YL- PROPIONYL]-PYRROLIDINE-2-(S)-CARBONITRILE	I,J	2AJL	0.76
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
605	4'-[(1R)-1-amino-2-(2,5-difluorophenyl)ethyl]biphenyl- 3-carboxamide	A,B	3D4L	0.73
SRD	D-1-NAPHTHYL-2-ACETAMIDO-ETHANE BORONIC ACID	B,C	4VGC	0.72
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBM	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBD	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1P06	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	1GBI	0.74
B2F	PHENYLALANINE BORONIC ACID	A,P	8LPR	0.74
BBA	2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE	A,B	1A5H	0.74
BBA	2,7-BIS-(4-AMIDINOBENZYLIDENE)- CYCLOHEPTAN-1-ONE	T	1V2N	0.74
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.75
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.75
PCS	PHENYLALANYLMETHYLCHLORIDE	B,D	1DLK	0.74
PCS	PHENYLALANYLMETHYLCHLORIDE	A	1XQX	0.74
DFA	DIPHENYLACETIC ACID	A,B,C	1GMY	0.71
PSS	ETHYLAMINOBENZYLMETHYLCARBONYL GROUP	A	1EAG	0.73
IPP	(P-IODOPHENYLACETYLAMINO)METHYLPHOSPHINIC ACID	A,B	1BLS	0.73
PHA	PHENYLALANINAL	A,B	1OB2	0.79
PHA	PHENYLALANINAL	V,Y,Z	2WDG	0.79
PHA	PHENYLALANINAL	V,Y,Z	2WDK	0.79
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	0.79
PHA	PHENYLALANINAL	P	3SGA	0.79
PHA	PHENYLALANINAL	A,B,C,D,E,F	1OB5	0.79
PHA	PHENYLALANINAL	V,Y,Z	2WDM	0.79
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	0.79
PHA	PHENYLALANINAL	A,B	1KDV	0.79
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	0.79
PHA	PHENYLALANINAL	A,B	1KDY	0.79
PHA	PHENYLALANINAL	V,Y,Z	3FIC	0.79
PHA	PHENYLALANINAL	V,Y,Z	2WDH	0.79
PHA	PHENYLALANINAL	A,B	1KE2	0.79
AC0	1-PHENYLETHANONE	A	1ZK1	0.71
AC0	1-PHENYLETHANONE	A	1ZK4	0.71
IPO	PARA-IODO-D-PHENYLALANINE HYDROXAMIC ACID	A	1IGB	0.76
BP4	BIPHENYL-4-YL-ACETALDEHYDE	A,B,E,F,G,H	1MHW	0.78
TPA	TRANS-2-PHENYLCYCLOPROPYLAMINE	A	1TNL	0.74
4PH	4-methyl-L-phenylalanine	B,C	3BV9	0.71
4PI	N-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINE	A,B	2NSD	0.7
BVA	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE	B,C	2P8O	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	0.7
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.82
1LP	TRANYLCYPROMINE	A,B	1OJB	0.77
BZQ	DIPHENYLMETHANONE	A,B	1GT5	0.75
BZQ	DIPHENYLMETHANONE	A,B	1DZP	0.75
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.71
44U	beta-phenyl-D-phenylalanyl-N-propyl- L-prolinamide	B,D	3DA9	0.74
DPN	D-PHENYLALANINE	P	1MCS	0.71
DPN	D-PHENYLALANINE	A	1GOE	0.71
DPN	D-PHENYLALANINE	A	2RM9	0.71
DPN	D-PHENYLALANINE	A	1SOC	0.71
DPN	D-PHENYLALANINE	B,C,E,F	1SFQ	0.71
DPN	D-PHENYLALANINE	I	1ABJ	0.71
DPN	D-PHENYLALANINE	P	1DWE	0.71
DPN	D-PHENYLALANINE	I,M	1HLT	0.71
DPN	D-PHENYLALANINE	A,H,L	1J9C	0.71
DPN	D-PHENYLALANINE	I,T	1TMB	0.71
DPN	D-PHENYLALANINE	A	2JRY	0.71
DPN	D-PHENYLALANINE	A	2SOC	0.71
DPN	D-PHENYLALANINE	A	2YYF	0.71
DPN	D-PHENYLALANINE	I	2HGT	0.71
DPN	D-PHENYLALANINE	A,D	2Q3I	0.71
DPN	D-PHENYLALANINE	A,P	1MCD	0.71
DPN	D-PHENYLALANINE	P	1HAO	0.71
DPN	D-PHENYLALANINE	A,B,I	1Z8J	0.71
DPN	D-PHENYLALANINE	A,B,C	2PGQ	0.71
DPN	D-PHENYLALANINE	C,D,H,I,L,M, X,Y	1DVA	0.71
DPN	D-PHENYLALANINE	P	1NRR	0.71
DPN	D-PHENYLALANINE	I	1PPB	0.71
DPN	D-PHENYLALANINE	C,D,G,H	1NU7	0.71
DPN	D-PHENYLALANINE	I	2HPP	0.71
DPN	D-PHENYLALANINE	B,C	2OD3	0.71
DPN	D-PHENYLALANINE	A	1B0Q	0.71
DPN	D-PHENYLALANINE	B,C,E,F	1NU9	0.71
DPN	D-PHENYLALANINE	A,B,I	1Z8I	0.71
DPN	D-PHENYLALANINE	H,I,J	1TMU	0.71
DPN	D-PHENYLALANINE	A,B,C,D,E,F	2DNS	0.71
DPN	D-PHENYLALANINE	A	1GO9	0.71
DPN	D-PHENYLALANINE	B,C,E,F	1A0H	0.71
DPN	D-PHENYLALANINE	P	1MCF	0.71
DPN	D-PHENYLALANINE	A	2RME	0.71
DPN	D-PHENYLALANINE	H,I	1TMT	0.71
DPN	D-PHENYLALANINE	I	1ABI	0.71
DPN	D-PHENYLALANINE	R	1NRQ	0.71
DPN	D-PHENYLALANINE	B,C,F,G	2A1D	0.71
DPN	D-PHENYLALANINE	A,B	2Q33	0.71
DPN	D-PHENYLALANINE	C,H,L	1DAN	0.71
DPN	D-PHENYLALANINE	P	1MCE	0.71
DPN	D-PHENYLALANINE	B,C,E,F	2A45	0.71
DPN	D-PHENYLALANINE	A	2RMI	0.71
DPN	D-PHENYLALANINE	A,B,I	1TQ7	0.71
DPN	D-PHENYLALANINE	A	1W7M	0.71
DPN	D-PHENYLALANINE	P	1HAP	0.71
DPN	D-PHENYLALANINE	A,B	1ORF	0.71
DPN	D-PHENYLALANINE	I	1IHS	0.71
DPN	D-PHENYLALANINE	P	1MCC	0.71
DPN	D-PHENYLALANINE	A	2RMD	0.71
DPN	D-PHENYLALANINE	A	2JQB	0.71
DPN	D-PHENYLALANINE	I	2HPQ	0.71
DPN	D-PHENYLALANINE	C,E,F	1SHH	0.71
DPN	D-PHENYLALANINE	A,I	1CVR	0.71
DPN	D-PHENYLALANINE	L,P	1AUT	0.71
DPN	D-PHENYLALANINE	P	1MCI	0.71
DPN	D-PHENYLALANINE	H,I	3F6U	0.71
DPN	D-PHENYLALANINE	A	1BFW	0.71
DPN	D-PHENYLALANINE	H,I	1HAI	0.71
DPN	D-PHENYLALANINE	B,C	2THF	0.71
DPN	D-PHENYLALANINE	I	1IHT	0.71
DPN	D-PHENYLALANINE	A,P	1MCJ	0.71
DPN	D-PHENYLALANINE	A	1TKH	0.71
DPN	D-PHENYLALANINE	C,H,L,T	2FIR	0.71
DPN	D-PHENYLALANINE	A	2FMZ	0.71
DPN	D-PHENYLALANINE	A	1YL9	0.71
DPN	D-PHENYLALANINE	I	1HUT	0.71
DPN	D-PHENYLALANINE	I	1FXY	0.71
DPN	D-PHENYLALANINE	A	1YL8	0.71
DPN	D-PHENYLALANINE	C,H,L	1QFK	0.71
DPN	D-PHENYLALANINE	P	1MCB	0.71
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.75
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.75
CPU		A,B	1CR6	0.71
PBN	4-PHENYLBUTYLAMINE	A	1TNI	0.75
PBN	4-PHENYLBUTYLAMINE	A	1UTP	0.75
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.72
TIO	(2-MERCAPTOMETHYL-3-PHENYL-PROPIONYL)- GLYCINE	E	1ZDP	0.7
1PB	1,4-DIPHENYL-2-BUTENE	A,B	1OJ9	0.7
007	1-METHYLAMINE-1-BENZYL-CYCLOPENTANE	A,B,C,D	2BUA	0.73
0A9	methyl L-phenylalaninate	A	1AY2	0.71
0A9	methyl L-phenylalaninate	I	5ER1	0.71
0A9	methyl L-phenylalaninate	I,P	1HDT	0.71
LEG	1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE	A,B	2PIN	0.73
BDB		A,B	1KE3	0.71
BHY	N,N'-[biphenyl-4,4'-diyldi(2R)propane- 2,1-diyl]dimethanesulfonamide	A,B	3BBR	0.7
HMF	2-AMINO-4-PHENYL-BUTYRIC ACID	I,J	1AY6	0.71
HPE	HOMOPHENYLALANINE	A,B	1B1H	0.71
BEY	(2S)-3-[(R)-[(1S)-1-amino-3-phenylpropyl](hydroxy)phosphoryl]- 2-benzylpropanoic acid	A	3EBI	0.72
GVQ	(2R)-2-(4-CHLOROPHENYL)-2-PHENYLETHANAMINE	A	2UW8	0.71
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.72
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.72