Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02878722

Ligand	Ligand name	Chain	PDB	Tanimoto
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.72
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.72
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.72
ISO	PARA-ISOPROPYLANILINE	A	1BMA	0.75
ISO	PARA-ISOPROPYLANILINE	A,B	1ELC	0.75
ISO	PARA-ISOPROPYLANILINE	A,B	1ELB	0.75
ISO	PARA-ISOPROPYLANILINE	A,B	1ELA	0.75
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.82
NR2	N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-4-METHYLBENZENESULFONAMIDE	A	1ZFK	0.81
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.73
GAS		B,H	1ETZ	0.73
GAS		H	2CGR	0.73
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.74
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.74
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.72
34A	3,4-DIMETHYLANILINE	A	1L4K	0.75
GEP	N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION	L	25C8	0.72
LIZ	N-{(1S,2S)-2-[bis(carboxymethyl)amino]cyclohexyl}-N-{(2R)-2-[bis(carboxymethyl)amino]-3-[4-({[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]carbamothioyl}amino)phenyl]propyl}glycine	A,B	3DSZ	0.71
12Q	1-METHYLQUINOLIN-2(1H)-ONE	A,B	2F64	0.72
1MR	N-METHYLANILINE	X	2OTZ	0.73
AGB	N-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREA	A	1EJN	0.79
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.73
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.73
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.73
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.73
CPU		A,B	1CR6	0.74
ZAT	4,4'-DIACETYLDIPHENYLUREA-BIS(GUANYLHYDRAZONE)	A	2W0J	0.85
N2T	(2S)-4-(2,5-DIFLUOROPHENYL)-N-METHYL-2-PHENYL-N-PIPERIDIN-4-YL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FKY	0.72
BSU	1,3-DIPHENYLUREA	A	3E85	0.88
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.88
4ND	N4-(N,N-DIPHENYLCARBAMOYL)-AMINOGUANIDINE	H,I	1NO9	0.74
264	(phenylamino)acetonitrile	A	2RBN	0.71
UN6	(3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]-METHYL}-PHENYL)-SULFAMIC ACID	A	2F70	0.72
NYL	N-ALLYL-ANILINE	A	1OVK	0.71
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.76
566	(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-3-CARBOXAMIDE	A	2H7I	0.71
SII	N-(4-{[4-(cyclohexylamino)-1-(3-fluorophenyl)-2-oxo-1,3,8-triazaspiro[4.5]dec-3-en-8-yl]methyl}phenyl)acetamide	A	3FKT	0.71
NSC	N,N'-BIS(4-AMINO-2-METHYLQUINOLIN-6-YL)UREA	A,B	1PWP	0.72
4PG	1-[4-(2-oxo-2-phenylethyl)phenyl]guanidine	U	2R2W	0.78
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	1UB5	0.75
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,B,H,L	3CFB	0.75
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	3CFD	0.75
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,L	1FL3	0.75
CF3	9,9,9-TRIFLUORO-8-OXO-N-PHENYLNONANAMIDE	A,B,C,D	2GH6	0.7
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.77
N5T	(2S)-4-(2,5-DIFLUOROPHENYL)-N,N-DIMETHYL-2-PHENYL-2,5-DIHYDRO-1H-PYRROLE-1-CARBOXAMIDE	A,B	2FL6	0.72
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A,B	2W98	0.71
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A,B	2BXC	0.71
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A	2BXP	0.71
P1Z	4-BUTYL-1,2-DIPHENYL-PYRAZOLIDINE-3,5-DIONE	A	2BXQ	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.7
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.7
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.7
GP6	1-(4-AMIDINOPHENYL)-3-(4-CHLOROPHENYL)UREA	A	1BJU	0.81
SH4	(1R)-1-PHENYLETHYL 4-(ACETYLAMINO)BENZYLPHOSPHONATE	H	1UM4	0.73
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.77
PRY	2-PROPYL-ANILINE	A	1OWY	0.76
INH	N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2-PHENYLETHYL)GLYCYL-L-ARGININE-N-PHENYLAMIDE	A	1SLN	0.7
INH	N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2-PHENYLETHYL)GLYCYL-L-ARGININE-N-PHENYLAMIDE	A	2SRT	0.7
INH	N-(R-CARBOXY-ETHYL)-ALPHA-(S)-(2-PHENYLETHYL)GLYCYL-L-ARGININE-N-PHENYLAMIDE	A	3BG8	0.7
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.81
IET	1-(4-CYANO-PHENYL)-3-[2-(2,6-DICHLORO-PHENYL)-1-IMINO-ETHYL]-THIOUREA	A	1S6P	0.72
LO1	[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-ACETIC ACID,	A	1WAX	0.73
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.83
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.73
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.76
DR1	5-METHYL-5H-INDOLO[3,2-B]QUINOLINE	A	1K9G	0.7
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.71
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.71
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.71
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.71
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.71
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.71
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.71
PL0	1-phenylguanidine	A	2O8W	0.75
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.76
RJ1	N-[2-chloro-5-(trifluoromethyl)phenyl]imidodicarbonimidic diamide	A,B,C,D	3DGA	0.71
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.81
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.81
BRN	BERENIL	A,B	268D	0.7
BRN	BERENIL	A,B	1D63	0.7
BRN	BERENIL	A,D,E	2GBY	0.7
BRN	BERENIL	A	2DBE	0.7
BRN	BERENIL	A	2GVR	0.7
IDM	INDOLINE	A,B	3CEP	0.74
IDM	INDOLINE	A	1AEK	0.74
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.71
MGR	MALACHITE GREEN	A,B	3BQZ	0.77
MGR	MALACHITE GREEN	A	1Q8N	0.77
MGR	MALACHITE GREEN	A,B	3BR0	0.77
MGR	MALACHITE GREEN	A,D,E	3BTL	0.77
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.77
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.77
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.71
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.71
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.79
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.79
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.72
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.71
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.77
MC2	N2-(L-PHENYLALANYL)-N1-(NAPHTHALENYL)-L-ARIGNINAMIDE	A	1T9Y	0.71
EOT	[(1-[(BIS-CARBOXYMETHYL-AMINO)-METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-AMINO]-ACETIC ACID	H	1INE	0.71
EOT	[(1-[(BIS-CARBOXYMETHYL-AMINO)-METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-AMINO]-ACETIC ACID	H	1IND	0.71
GA0	GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE	A	2DCM	0.72
A8B		A	1ODC	0.71
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.74
SC5	2-[((R)-{[4-(AMINOMETHYL)PHENYL]AMINO}{[(1R)-1-PHENYLETHYL]AMINO}METHYL)AMINO]ETHANE-1,1-DIOL	H	1YNK	0.81
TSN	TRICHOSTATIN A	A,B	1T64	0.7
TSN	TRICHOSTATIN A	A,B	1C3R	0.7
TSN	TRICHOSTATIN A	A,B,C	3F0R	0.7
TSN	TRICHOSTATIN A	A,B,C	3C10	0.7