Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00043821

Ligand	Ligand name	Chain	PDB	Tanimoto
B3N	4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE	A,B	3F06	0.71
B3N	4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE	A,B	3EZP	0.71
B3N	4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE	A	3EW8	0.71
B3N	4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE	A,B	3EZT	0.71
B3N	4-DIMETHYLAMINO-N-(6-HYDROXYCARBAMOYETHYL)BENZAMIDE-N-HYDROXY-7-(4-DIMETHYLA MINOBENZOYL)AMINOHEPTANAMIDE	A	1T67	0.71
UN6	(3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]-METHYL}-PHENYL)-SULFAMIC ACID	A	2F70	0.74
AEN	5-(1-SULFONAPHTHYL)-ACETYLAMINO-ETHYLAMINE	A	1RAR	0.7
AEN	5-(1-SULFONAPHTHYL)-ACETYLAMINO-ETHYLAMINE	A	1RAS	0.7
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.72
SN8	1,6-DIMETHYL-4-(4-(4-(1-METHYLPYRIDINIUM-4-YLAMINO)PHENYLCARBAMOYL)PHENYLAMINO)QUINOLINIUM	A,B	1ZPH	0.71
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.75
TK4	2-ACETYLAMINO-NAPTHALENE-1,5-DISULFONIC ACID	H,L	1C5C	0.75
12B	BENZO[CD]INDOL-2(1H)-ONE	A,B	2F67	0.72
GP6	1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA	A	1BJU	0.72
GEP	N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION	L	25C8	0.77
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.79
LO1	[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-ACETIC ACID,	A	1WAX	0.83
BOS	N-[4-(AMINOSULFONYL)PHENYL]-2-MERCAPTOBENZAMIDE	A	2HD6	0.72
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.7
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.7
ISN	ISATIN	A,B	1OJA	0.75
ISN	ISATIN	A,B	2BK5	0.75
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	1UB5	0.78
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,B,H,L	3CFB	0.78
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	3CFD	0.78
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,L	1FL3	0.78
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.73
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.75
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.75
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.75
PNC	PARA-NITROBENZYL GLUTARYL GLYCINIC ACID	L	1YEF	0.7
4PG	1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine	U	2R2W	0.73
W22	[(2S)-4-methyl-3-oxo-2,3,4,5-tetrahydro-1H-1,4-benzodiazepin-2-yl]acetic acid	A,B	2WKW	0.71
G3E	3-hydroxyquinolin-2(1H)-one	A,B,C,D	3G3E	0.79
221	(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE	A,B	2IJN	0.74
264	(phenylamino)acetonitrile	A	2RBN	0.76
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1TV5	0.78
A26	2-CYANO-3-HYDROXY-N-(4-TRIFLUOROMETHYL-PHENYL)-BUTYRAMIDE	A	1D3H	0.78
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1-DIOXIDE	A	2BGE	0.75
IDM	INDOLINE	A,B	3CEP	0.81
IDM	INDOLINE	A	1AEK	0.81
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIM	0.71
PHC	N-METHYL-N-(METHYLBENZYL)FORMAMIDE	A,B	1BIL	0.71
ASR	4-AMINOPHENYLARSONIC ACID	A	1N4F	0.71
HFT	HYDROXYFLUTAMIDE	A	2AX6	0.75
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.72
NOX	N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM-N-OXIDE	L	35C8	0.73
271	N-methyl-1-phenylmethanamine	X	2RBT	0.71
AHC	4-AMINOHYDROCINNAMIC ACID	A,B	2AY1	0.73
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.85
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.85
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.73
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.73
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.73
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.73
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.73
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.73
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.73
EOB	{1,3-PHENYLENEBIS[IMINO(2-OXOETHANE-2,1-DIYL)]}BIS(PHOSPHONIC ACID)	A,B,C,D	2FZG	0.76
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.72
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.72
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.72
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.78
3AB	3-aminobenzamide	A,B,C,D	3GOY	0.75
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.77
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.77
1MR	N-METHYLANILINE	X	2OTZ	0.78
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.75
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	B,C,D	1TYM	0.7
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	B,C,D	1TYL	0.7
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A	2OCU	0.7
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A,B,C,D,F	3DJI	0.7
TYL	N-(4-HYDROXYPHENYL)ACETAMIDE (TYLENOL)	A	2DPZ	0.7
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.73
TSN	TRICHOSTATIN A	A,B	1T64	0.74
TSN	TRICHOSTATIN A	A,B	1C3R	0.74
TSN	TRICHOSTATIN A	A,B,C	3F0R	0.74
TSN	TRICHOSTATIN A	A,B,C	3C10	0.74
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.75
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.87
12Q	1-METHYLQUINOLIN-2(1H)-ONE	A,B	2F64	0.81
GIN	2-{[(6-OXO-1,6-DIHYDROPYRIDIN-3-YL)METHYL]AMINO}-N-[4-PROPYL-3-(TRIFLUOROMETHYL)PHENYL]BENZAMIDE	A,B	2HZ0	0.7
566	(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-3-CARBOXAMIDE	A	2H7I	0.74
SH4	(1R)-1-PHENYLETHYL 4-(ACETYLAMINO)BENZYLPHOSPHONATE	H	1UM4	0.75
PYQ	PYROQUILON	A	1JA9	0.71
PYQ	PYROQUILON	A,B,C,D	1G0O	0.71
468	(3S)-N-(3-CHLORO-2-METHYLPHENYL)-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE	A	2H7P	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.73
MGR	MALACHITE GREEN	A	1Q8N	0.73
MGR	MALACHITE GREEN	A,B	3BR0	0.73
MGR	MALACHITE GREEN	A,D,E	3BTL	0.73
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.73
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.73
APB	M-AMINOPHENYLBORONIC ACID	A,B	3BLS	0.71
ANL	ANILINE	A	2OV4	0.71
ANL	ANILINE	A	1AEE	0.71
ANL	ANILINE	A	1PPA	0.71
ANL	ANILINE	A	1HJ9	0.71
CF3	9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE	A,B,C,D	2GH6	0.8
IXM	(Z)-1H,1'H-[2,3']BIINDOLYLIDENE-3,2'-DIONE-3-OXIME	A,B	1Q41	0.71
IXM	(Z)-1H,1'H-[2,3']BIINDOLYLIDENE-3,2'-DIONE-3-OXIME	A,B	1UNH	0.71
IXM	(Z)-1H,1'H-[2,3']BIINDOLYLIDENE-3,2'-DIONE-3-OXIME	A	2QKR	0.71
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.78
GA0	GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE	A	2DCM	0.74
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.71
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.71
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.88
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.89
DOE	(S)-2-(4-(2-(2-HYDROXYETHYLTHIO)-ACETAMIDO)-BENZYL)-1,4,7,10-TETRAAZACYCLODODECANE-N,N',N'',N'''-TETRAACETATE	A,B,C,D	1NC2	0.71
SU2	3-[4-(1-FORMYLPIPERAZIN-4-YL)-BENZYLIDENYL]-2-INDOLINONE	A,B	1AGW	0.71
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.71
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
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.81
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.81
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.81
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.81
BHM	(R)-3-BROMO-2-HYDROXY-2-METHYL-N-[4-NITRO-3-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A	2AX9	0.72
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.8
FPA	1,1 DIFLUORO-N-PHENYLETHYL ACETAMIDE	E,I	4EST	0.72
TYX	S-(2-ANILINO-2-OXOETHYL)-L-CYSTEINE	A	2PQT	0.7
CRI		A,B	1VKG	0.71
744	(3S)-N-(5-CHLORO-2-METHYLPHENYL)-1-CYCLOHEXYL-5-OXOPYRROLIDINE-3-CARBOXAMIDE	A	2H7N	0.71
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.86
PL0	1-phenylguanidine	A	2O8W	0.72
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.76
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.76
H16	6-CHLORO-4-(CYCLOHEXYLSULFANYL)-3-PROPYLQUINOLIN-2(1H)-ONE	A	1TKZ	0.7
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.77
NYL	N-ALLYL-ANILINE	A	1OVK	0.78
SC5	2-[((R)-{[4-(AMINOMETHYL)PHENYL]AMINO}{[(1R)-1-PHENYLETHYL]AMINO}METHYL)AMINO]ETHANE-1,1-DIOL	H	1YNK	0.71
BSU	1,3-DIPHENYLUREA	A	3E85	0.77
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.77
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.73
CBE	2-METHYL-N-PHENYL-5,6-DIHYDRO-1,4-OXATHIINE-3-CARBOXAMIDE	A,B,C,D,N,O,P,Q	2FBW	0.73
34A	3,4-DIMETHYLANILINE	A	1L4K	0.81
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
FEN	N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE	A	1FEL	0.7
NR2	N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-4-METHYLBENZENESULFONAMIDE	A	1ZFK	0.74
PRY	2-PROPYL-ANILINE	A	1OWY	0.82
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.79
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.79
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.81
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.81
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.81
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.81