Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03202583

Ligand	Ligand name	Chain	PDB	Tanimoto
FOE	2-(2-AMINO-3-OXO-PROPYLSULFANYL)-N-(4-FLUORO-PHENYL)-N-ISOPROPYL-ACETAMIDE	B	1BX9	0.72
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.77
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.77
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.74
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.7
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.74
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.74
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.74
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.74
NIT	4-NITROANILINE	C,D	1RMH	0.71
NIT	4-NITROANILINE	A,B,D,F,G,H,I	2IXP	0.71
NIT	4-NITROANILINE	B	1VBS	0.71
NIT	4-NITROANILINE	C	1V9T	0.71
NIT	4-NITROANILINE	C,D	1VBT	0.71
NIT	4-NITROANILINE	B	1LOP	0.71
NIT	4-NITROANILINE	C,D	1ZKF	0.71
NIT	4-NITROANILINE	B	1PIP	0.71
NPP	N-(2-AMINO-ETHYL)-4,6-DINITRO-N'-(2,2,6,6-TETRAMETHYL-1-OXY-PIPERIDIN-4-YL)-BENZENE-1,3-DIAMINE	L	1BAF	0.71
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.8
PRY	2-PROPYL-ANILINE	A	1OWY	0.72
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.71
CF3	9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE	A,B,C,D	2GH6	0.72
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.7
TYX	S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE	A	2PQT	0.71
PL0	1-phenylguanidine	A	2O8W	0.79
A8B		A	1ODC	0.72
1AN	2-FLUOROANILINE	A	1LGW	0.74
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.7
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.7
1MR	N-METHYLANILINE	X	2OTZ	0.91
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.72
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.72
IDM	INDOLINE	A,B	3CEP	0.79
IDM	INDOLINE	A	1AEK	0.79
5AN	3,5-DIFLUOROANILINE	A	1LGX	0.72
271	N-methyl-1-phenylmethanamine	X	2RBT	0.71
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.75
34A	3,4-DIMETHYLANILINE	A	1L4K	0.7
PHZ	1-PHENYLHYDRAZINE	A	2E2T	0.73
PHZ	1-PHENYLHYDRAZINE	D,H	2AGL	0.73
EOB	{1,3-PHENYLENEBIS[IMINO(2-OXOETHANE-2,1-DIYL)]}BIS(PHOSPHONIC ACID)	A,B,C,D	2FZG	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.71
MGR	MALACHITE GREEN	A	1Q8N	0.71
MGR	MALACHITE GREEN	A,B	3BR0	0.71
MGR	MALACHITE GREEN	A,D,E	3BTL	0.71
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.71
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.71
ZLD	N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	0,1,2,4,9,A,B,C,F,H,I,J,K,L,M,N,P,Q,R,S,T,X,Y,Z	3CPW	0.71
ZLD	N-{[(5S)-3-(3-fluoro-4-morpholin-4-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl}acetamide	4,M,X,Y,Z	3DLL	0.71
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.72
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.75
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.82
PDM	4-[4-(2,5-DIOXO-PYRROLIDIN-1-YL)-PHENYLAMINO]-4-HYDROXY-BUTYRIC ACID	A,B,C	1L2O	0.71
PDM	4-[4-(2,5-DIOXO-PYRROLIDIN-1-YL)-PHENYLAMINO]-4-HYDROXY-BUTYRIC ACID	A,C	1KWO	0.71
OSP	SULTHIAME	A	2Q1Q	0.71
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1-DIOXIDE	A	2BGE	0.76
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.75
NYL	N-ALLYL-ANILINE	A	1OVK	0.93
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.8
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.8
264	(phenylamino)acetonitrile	A	2RBN	0.92
566	(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-3-CARBOXAMIDE	A	2H7I	0.75
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.75
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.81
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.81
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.78
ANL	ANILINE	A	2OV4	0.76
ANL	ANILINE	A	1AEE	0.76
ANL	ANILINE	A	1PPA	0.76
ANL	ANILINE	A	1HJ9	0.76
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.78
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.79
BSU	1,3-DIPHENYLUREA	A	3E85	0.77
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.77
PNQ	P-NITROPHENYL AMINOETHYLDIPHOSPHATE BERYLLIUM TRIFLUORIDE	A	1D0Z	0.72
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.8