MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02334946

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
AC0	1-PHENYLETHANONE	A	1ZK1	0.78
AC0	1-PHENYLETHANONE	A	1ZK4	0.78
IPO	PARA-IODO-D-PHENYLALANINE HYDROXAMIC ACID	A	1IGB	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
CVB	4-(CARBOXYVIN-2-YL)PHENYLBORONIC ACID	A,B	1KE0	0.72
DMW	2,3-DIMETHYL-1,4-NAPHTHOQUINONE	A,B,C,D,E,F	2BS4	0.7
1LP	TRANYLCYPROMINE	A,B	1OJB	0.71
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
I4B	ISOBUTYLBENZENE	A	184L	0.72
SP8	N-{(1S)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide	A,B	3CNS	0.72
V15	2-AMINO-6-(2-PHENYLETHYL)PYRIMIDIN- 4(3H)-ONE	A	2V00	0.71
FPR	PROPYLBENZENE	C	1RHK	0.74
BVA	TRIHYDROXY[(N-HYDROXYBENZAMIDATO)OXO]VANADATE	B,C	2P8O	0.77
FBA	4-FLUOROBENZYLAMINE	B,D,E	1AFQ	0.72
FBA	4-FLUOROBENZYLAMINE	A	1TNH	0.72
PHM	PHENYLALANYLMETHANE	A,I	1PJP	0.76
PHM	PHENYLALANYLMETHANE	A,B,C	2J9J	0.76
PHM	PHENYLALANYLMETHANE	A,B,C	2JE4	0.76
FRD	1-PHENYL-2-AMINOPROPANE	A,C	2AOI	0.74
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOF	0.74
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOJ	0.74
FRD	1-PHENYL-2-AMINOPROPANE	A,B,C	2AOH	0.74
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.73
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.73
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
MBN	TOLUENE	A,B	3D7O	0.73
MBN	TOLUENE	A,B	1R1X	0.73
MBN	TOLUENE	A,B	1JLX	0.73
MBN	TOLUENE	A,B,C,D	3D17	0.73
MBN	TOLUENE	A,B	2VRL	0.73
MBN	TOLUENE	A,I	2Z3E	0.73
MBN	TOLUENE	A,B	1YZI	0.73
MBN	TOLUENE	A,B	2DN1	0.73
MBN	TOLUENE	A,B	3EN1	0.73
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.73
263	1-(azidomethyl)-3-methylbenzene	X	2RB2	0.72
OXE	ORTHO-XYLENE	A,B	3E0X	0.72
OXE	ORTHO-XYLENE	A	188L	0.72
PXY	PARA-XYLENE	A	187L	0.74
PXY	PARA-XYLENE	A	225L	0.74
NFP	3-AMINO-5-PHENYLPENTANE	A	1MEM	0.73
NFP	3-AMINO-5-PHENYLPENTANE	A,D,E	1FH0	0.73
PBA	PHENYLETHANE BORONIC ACID	C,G	6CHA	0.72
PHA	PHENYLALANINAL	A,B	1OB2	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDG	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDK	0.73
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	0.73
PHA	PHENYLALANINAL	P	3SGA	0.73
PHA	PHENYLALANINAL	A,B,C,D,E,F	1OB5	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDM	0.73
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	0.73
PHA	PHENYLALANINAL	A,B	1KDV	0.73
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	0.73
PHA	PHENYLALANINAL	A,B	1KDY	0.73
PHA	PHENYLALANINAL	V,Y,Z	3FIC	0.73
PHA	PHENYLALANINAL	V,Y,Z	2WDH	0.73
PHA	PHENYLALANINAL	A,B	1KE2	0.73
GB5	(2E)-3-(4-CHLOROPHENYL)-N-HYDROXYACRYLAMIDE	A,B	2ILP	0.77
N4B	N-BUTYLBENZENE	A	186L	0.74
NFA	PHENYLALANINE AMIDE	A,B,C,D	2BTJ	0.77
NFA	PHENYLALANINE AMIDE	A,B,C,D,E,F	2EFX	0.77
NFA	PHENYLALANINE AMIDE	A,B,C,D	2VVJ	0.77
NFA	PHENYLALANINE AMIDE	A	2A4O	0.77
NFA	PHENYLALANINE AMIDE	A,B	1XAE	0.77
NFA	PHENYLALANINE AMIDE	A,B,C,D	2OGR	0.77
NFA	PHENYLALANINE AMIDE	A,B,C,D	1QA7	0.77
NFA	PHENYLALANINE AMIDE	A,B,C,D	2GW4	0.77
ABN	BENZYLAMINE	D,H	2HXC	0.74
ABN	BENZYLAMINE	A,I	1A86	0.74
ABN	BENZYLAMINE	A	1UTN	0.74
ABN	BENZYLAMINE	A	1N6X	0.74
ABN	BENZYLAMINE	A	2BZA	0.74
ABN	BENZYLAMINE	A	2EUS	0.74
ABN	BENZYLAMINE	A	1N6Y	0.74
ABN	BENZYLAMINE	A	1UTJ	0.74
GB4	(2E)-3-(2,4-DICHLOROPHENYL)-N-HYDROXYACRYLAMIDE	A,B	2IMA	0.73
PYL	PHENYLETHANE	C	1B07	0.74
PYL	PHENYLETHANE	A,B	2VRM	0.74
PYL	PHENYLETHANE	A	1NHB	0.74
EOA	N-PHENETHYL-FORMAMIDE	H,I	1A5G	0.71
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE6	0.73
TCA	PHENYLETHYLENECARBOXYLIC ACID	A	1BE8	0.73
TCA	PHENYLETHYLENECARBOXYLIC ACID	A,B,C,D,E,F, G,H	2O78	0.73
HBX	benzaldehyde	A,B	3GDN	0.73
BZQ	DIPHENYLMETHANONE	A,B	1GT5	0.73
BZQ	DIPHENYLMETHANONE	A,B	1DZP	0.73
267	1-(azidomethyl)-3-methylbenzene	A	2RBQ	0.72
PO0	1-BENZYL-(R)-PROPYLAMINE	A,I	1LZQ	0.74
PO0	1-BENZYL-(R)-PROPYLAMINE	B,I	1M0B	0.74
LEG	1-(4-HEXYLPHENYL)PROP-2-EN-1-ONE	A,B	2PIN	0.75
PRA	3-PHENYLPROPYLAMINE	A	1TNK	0.75
PRA	3-PHENYLPROPYLAMINE	M	1UTL	0.75
VK3	MENADIONE	A	1TUV	0.7
VK3	MENADIONE	A,B	2QR2	0.7
3PL	3-PHENYLPROPANAL	E	1Y3G	0.73
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
271	N-methyl-1-phenylmethanamine	X	2RBT	0.72
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.71
HPQ	HOMOPHENYLALANINYLMETHANE	B	1EWP	0.76
SP9	N-{(1R)-3-[(4-aminobutyl)amino]- 1-methylpropyl}benzamide	A,B	3CNT	0.72
TTX	TENTOXIN	B	1KMH	0.7
BHO	BENZHYDROXAMIC ACID	A,B	1GX2	0.79
BHO	BENZHYDROXAMIC ACID	A	1HSR	0.79
BHO	BENZHYDROXAMIC ACID	A,B	2ATJ	0.79
BHO	BENZHYDROXAMIC ACID	A,B	4ATJ	0.79
BHO	BENZHYDROXAMIC ACID	A,B	3ATJ	0.79
BHO	BENZHYDROXAMIC ACID	A	3GCK	0.79
BHO	BENZHYDROXAMIC ACID	A,B,C,D,E,F, G,H	2BOY	0.79
23F	(2Z)-2-AMINO-3-PHENYLACRYLIC ACID	A	1VRZ	0.74