Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00019844

Ligand	Ligand name	Chain	PDB	Tanimoto
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.76
TTT	5-amino-2-methyl-N-[(1R)-1-naphthalen-1-ylethyl]benzamide	A	3E9S	0.71
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.72
NOX	N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM-N-OXIDE	L	35C8	0.72
ANC	ANTHRACEN-1-YLAMINE	A,B	1GT1	0.7
ANC	ANTHRACEN-1-YLAMINE	A,B	1HN2	0.7
SU2	3-[4-(1-FORMYLPIPERAZIN-4-YL)-BENZYLIDENYL]-2-INDOLINONE	A,B	1AGW	0.73
TK4	2-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACID	H,L	1C5C	0.74
BOS	N-[4-(AMINOSULFONYL)PHENYL]-2-MERCAPTOBENZAMIDE	A	2HD6	0.7
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.78
LO1	[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-ACETIC ACID,	A	1WAX	0.8
BAN	HONH-BENZYLMALONYL-L-ALANYLGLYCINE-P-NITROANILIDE	A	5TLN	0.7
PYQ	PYROQUILON	A	1JA9	0.7
PYQ	PYROQUILON	A,B,C,D	1G0O	0.7
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.7
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.7
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.7
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.7
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.7
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.7
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.7
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.84
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.84
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.84
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.84
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.7
44B	1,1,1,3,3,3-HEXAFLUORO-2-{4-[(2,2,2-TRIFLUOROETHYL)AMINO]PHENYL}PROPAN-2-OL	A,B,C,D	1PQ9	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.74
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.74
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.74
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.74
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.73
ISN	ISATIN	A,B	1OJA	0.73
ISN	ISATIN	A,B	2BK5	0.73
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.73
4PG	1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine	U	2R2W	0.73
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.9
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1-DIOXIDE	A	2BGE	0.73
12B	BENZO[CD]INDOL-2(1H)-ONE	A,B	2F67	0.73
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.7
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.7
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.7
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.85
UN6	(3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]-METHYL}-PHENYL)-SULFAMIC ACID	A	2F70	0.72
GEP	N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION	L	25C8	0.75
NYL	N-ALLYL-ANILINE	A	1OVK	0.76
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.77
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.77
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.73
34T	(3R)-8-(dioxidosulfanyl)-3-methyl-1,2,3,4-tetrahydroquinoline	H	1ETR	0.71
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1TV5	0.77
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1D3H	0.77
CRI		A,B	1VKG	0.72
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.78
CF3	9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE	A,B,C,D	2GH6	0.78
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.85
HFT	HYDROXYFLUTAMIDE	A	2AX6	0.73
221	(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE	A,B	2IJN	0.75
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.73
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.72
CBE	2-METHYL-N-PHENYL-5,6-DIHYDRO-1,4-OXATHIINE-3-CARBOXAMIDE	A,B,C,D,N,O,P,Q	2FBW	0.72
AGB	N-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREA	A	1EJN	0.7
EOB	{1,3-PHENYLENEBIS[IMINO(2-OXOETHANE-2,1-DIYL)]}BIS(PHOSPHONIC ACID)	A,B,C,D	2FZG	0.74
GA0	GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE	A	2DCM	0.73
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.73
BSU	1,3-DIPHENYLUREA	A	3E85	0.75
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.75
468	(3S)-N-(3-CHLORO-2-METHYLPHENYL)-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE	A	2H7P	0.71
4AN	6-AMINO-BENZO[DE]ISOQUINOLINE-1,3-DIONE	A	2PAX	0.7
PRY	2-PROPYL-ANILINE	A	1OWY	0.79
SN8	1,6-DIMETHYL-4-(4-(4-(1-METHYLPYRIDINIUM-4-YLAMINO)PHENYLCARBAMOYL)PHENYLAMINO)QUINOLINIUM	A,B	1ZPH	0.72
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.84
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.75
SH4	(1R)-1-PHENYLETHYL 4-(ACETYLAMINO)BENZYLPHOSPHONATE	H	1UM4	0.74
264	(phenylamino)acetonitrile	A	2RBN	0.74
566	(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-3-CARBOXAMIDE	A	2H7I	0.73
TSN	TRICHOSTATIN A	A,B	1T64	0.75
TSN	TRICHOSTATIN A	A,B	1C3R	0.75
TSN	TRICHOSTATIN A	A,B,C	3F0R	0.75
TSN	TRICHOSTATIN A	A,B,C	3C10	0.75
12Q	1-METHYLQUINOLIN-2(1H)-ONE	A,B	2F64	0.79
NR2	N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-4-METHYLBENZENESULFONAMIDE	A	1ZFK	0.72
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	1UB5	0.76
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,B,H,L	3CFB	0.76
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	3CFD	0.76
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,L	1FL3	0.76
34A	3,4-DIMETHYLANILINE	A	1L4K	0.8
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.71
9AP	9-AMINOPHENANTHRENE	A	1EGY	0.71
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.76
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.76
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A,B	2W98	0.72
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A,B	2BXC	0.72
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A	2BXP	0.72
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A	2BXQ	0.72
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.79
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.79
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.79
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.79
IDM	INDOLINE	A,B	3CEP	0.78
IDM	INDOLINE	A	1AEK	0.78
MGR	MALACHITE GREEN	A,B	3BQZ	0.72
MGR	MALACHITE GREEN	A	1Q8N	0.72
MGR	MALACHITE GREEN	A,B	3BR0	0.72
MGR	MALACHITE GREEN	A,D,E	3BTL	0.72
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.72
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.72
744	(3S)-N-(5-CHLORO-2-METHYLPHENYL)-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE	A	2H7N	0.71
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.82
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.82
G3E	3-hydroxyquinolin-2(1H)-one	A,B,C,D	3G3E	0.77
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.75
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.71
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.76
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.76
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.7
BHM	(R)-3-BROMO-2-HYDROXY-2-METHYL-N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A	2AX9	0.7
FEN	N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE	A	1FEL	0.7
1MR	N-METHYLANILINE	X	2OTZ	0.76
675	6-[(Z)-AMINO(IMINO)METHYL]-N-PHENYL-2-NAPHTHAMIDE	A	1OWE	0.71