Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00571699

Ligand	Ligand name	Chain	PDB	Tanimoto
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELE	0.73
ANI	4-TRIFLUOROMETHYLANILINE	E,I	7EST	0.73
ANI	4-TRIFLUOROMETHYLANILINE	E,I	2EST	0.73
ANI	4-TRIFLUOROMETHYLANILINE	E,I	1ELD	0.73
UA5	(4-ETHYLPHENYL)SULFAMIC ACID	A,B	2I5X	0.71
RM1	N-METHYL-1(R)-AMINOINDAN	A,B	2C67	0.72
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A,B	1EK1	0.77
CIU	N-CYCLOHEXYL-N'-(4-IODOPHENYL)UREA	A	1VJ5	0.77
AGB	N-(1-ADAMANTYL)-N'-(4-GUANIDINOBENZYL)UREA	A	1EJN	0.71
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	1UB5	0.72
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,B,H,L	3CFB	0.72
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	B,H	3CFD	0.72
SPB	4-(4-STYRYL-PHENYLCARBAMOYL)-BUTYRIC ACID	A,L	1FL3	0.72
221	(2R,3R)-3-{[3,5-BIS(TRIFLUOROMETHYL)PHENYL]AMINO}-2-CYANO-3-THIOXOPROPANAMIDE	A,B	2IJN	0.72
NR2	N-({[4-(AMINOSULFONYL)PHENYL]AMINO}CARBONYL)-4-METHYLBENZENESULFONAMIDE	A	1ZFK	0.71
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
CVI	CRYSTAL VIOLET	A,B,D,E	1JTX	0.79
G1L	3-CHLORO-2,2-DIMETHYL-N-[4-(TRIFLUOROMETHYL)PHENYL]PROPANAMIDE	A,B	2I80	0.72
PBZ	P-AMINO BENZAMIDINE	A,B	2BDG	0.72
PBZ	P-AMINO BENZAMIDINE	A	1RFN	0.72
PBZ	P-AMINO BENZAMIDINE	A,B,C,D,E,F,G,H,I,J,K,L,M,N,O,P	2BDI	0.72
PBZ	P-AMINO BENZAMIDINE	A,B,C,D	2BDH	0.72
PBZ	P-AMINO BENZAMIDINE	A	1FIZ	0.72
PBZ	P-AMINO BENZAMIDINE	A	1FIW	0.72
PBZ	P-AMINO BENZAMIDINE	H,L,T	2A2Q	0.72
BL5		A,B	1RL4	0.71
GEP	N-METHYL-N-(PARA-GLUTARAMIDOPHENYL-ETHYL)-PIPERIDINIUM ION	L	25C8	0.7
UN6	(3-{[3-(3-SULFOAMINO-PHENYL)-PROPIONYLAMINO]-METHYL}-PHENYL)-SULFAMIC ACID	A	2F70	0.75
MNS	5-(DIMETHYLAMINO)-1-NAPHTHALENESULFONAMIDE	A	1OKL	0.7
BAN	HONH-BENZYLMALONYL-L-ALANYLGLYCINE-P-NITROANILIDE	A	5TLN	0.72
34A	3,4-DIMETHYLANILINE	A	1L4K	0.75
AEN	5-(1-SULFONAPHTHYL)-ACETYLAMINO-ETHYLAMINE	A	1RAR	0.72
AEN	5-(1-SULFONAPHTHYL)-ACETYLAMINO-ETHYLAMINE	A	1RAS	0.72
12Q	1-METHYLQUINOLIN-2(1H)-ONE	A,B	2F64	0.72
BRN	BERENIL	A,B	268D	0.71
BRN	BERENIL	A,B	1D63	0.71
BRN	BERENIL	A,D,E	2GBY	0.71
BRN	BERENIL	A	2DBE	0.71
BRN	BERENIL	A	2GVR	0.71
IXX	3-(5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q72	0.83
PRY	2-PROPYL-ANILINE	A	1OWY	0.77
2BF	ALPHA-BENZYL-AMINOBENZYL-PHOSPHONIC ACID	A,B,C,D	1ND5	0.74
150	4,5-DIMETHYL-1,2-PHENYLENEDIAMINE	A	1L4F	0.74
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A	1QWC	0.7
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1FOI	0.7
14W	N-(3-(AMINOMETHYL)BENZYL)ACETAMIDINE	A,B	1QW5	0.7
BTM	N-benzyl-N,N-diethylethanaminium	A,B	2Q9Y	0.73
BSU	1,3-DIPHENYLUREA	A	3E85	0.76
BSU	1,3-DIPHENYLUREA	A	2ZJF	0.76
MGR	MALACHITE GREEN	A,B	3BQZ	0.79
MGR	MALACHITE GREEN	A	1Q8N	0.79
MGR	MALACHITE GREEN	A,B	3BR0	0.79
MGR	MALACHITE GREEN	A,D,E	3BTL	0.79
MGR	MALACHITE GREEN	A,B,D,E	3BTC	0.79
MGR	MALACHITE GREEN	A,B,D,E	1JUP	0.79
LGD	6-[BIS(2,2,2-TRIFLUOROETHYL)AMINO]-4-(TRIFLUOROMETHYL)QUINOLIN-2(1H)-ONE	A	2HVC	0.74
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1C3S	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C	3C0Z	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A	1T69	0.7
SHH	OCTANEDIOIC ACID HYDROXYAMIDE PHENYLAMIDE	A,B,C,D	1ZZ1	0.7
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	2BK4	0.71
RAS	N-PROPARGYL-1(R)-AMINONDAN	A,B	1S2Q	0.71
T2D	1,2,5-THIADIAZOLIDIN-3-ONE-1,1-DIOXIDE	A	2BGE	0.74
271	N-methyl-1-phenylmethanamine	X	2RBT	0.76
IS2	[(4-ETHYLPHENYL)AMINO]CARBONYLPHOSPHONIC ACID	A	1O4J	0.74
EOT	[(1-[(BIS-CARBOXYMETHYL-AMINO)-METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-AMINO]-ACETIC ACID	H	1INE	0.7
EOT	[(1-[(BIS-CARBOXYMETHYL-AMINO)-METHYL]-2-{4-[3-(2-HYDROXY-ETHYL)-THIOUREIDO]-PHENY}-ETHYL)-CARBOXYMETHYL-AMINO]-ACETIC ACID	H	1IND	0.7
URS	N-PHENYLTHIOUREA	A,B	1BUG	0.73
NP2	N-(3-AMINOPROPYL)-2-NITROBENZENAMINE	A	1WUM	0.77
SU2	3-[4-(1-FORMYLPIPERAZIN-4-YL)-BENZYLIDENYL]-2-INDOLINONE	A,B	1AGW	0.72
EBW	4-(5-{4-[DIMETHYL(PROP-2-ENYL)AMMONIO]PHENYL}-3-OXOPENTYL)-N,N-DIMETHYL-N-PROP-2-ENYLBENZENAMINIUM	A	1E3Q	0.77
PNZ	P-NITRO-BENZYLAMINE	A,D,H	2HJ4	0.73
PNZ	P-NITRO-BENZYLAMINE	A,B	2C70	0.73
TRJ	META-DI(AMINOMETHYL)BENZENE	A,I	1GVV	0.71
TRJ	META-DI(AMINOMETHYL)BENZENE	A	1FQ5	0.71
NYL	N-ALLYL-ANILINE	A	1OVK	0.85
LO1	[[4-(AMINOMETHYL)PHENYL]AMINO]OXO-ACETIC ACID,	A	1WAX	0.75
G3G	N,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE)	A,B	2R43	0.73
G3G	N,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE)	A,B	2PWC	0.73
G3G	N,N'-(3S,4S)-PYRROLIDINE-3,4-DIYLBIS(4-AMINO-N-BENZYLBENZENESULFONAMIDE)	A,B	2R3W	0.73
ANC	ANTHRACEN-1-YLAMINE	A,B	1GT1	0.71
ANC	ANTHRACEN-1-YLAMINE	A,B	1HN2	0.71
CXX	3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2Q6H	0.75
CXX	3-(3-CHLORO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N,N-DIMETHYLPROPAN-1-AMINE	A	2QEI	0.75
TPM	2-(4-AMINOBENZYLAMINO)-3,4,5,6-TETRAHYDROPYRIDINIUM	J,K,L	1F3D	0.8
OCH	QUINOLIN-2(1H)-ONE	A,B,C,D,E,F	1Z03	0.75
PHJ	N-[(AMINOOXY)CARBONYL]-N-PHENYLAMINE	A,B	1UR9	0.72
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	0.72
DR1	5-METHYL-5H-INDOLO[3,2-B]QUINOLINE	A	1K9G	0.77
171	2-PHENYLAMINO-ETHANESULFONIC ACID	A,B	1SXG	0.74
FLM	3-FLUORO-2-METHYL-ANILINE	A	1OVJ	0.74
LJG	N,N'-(iminodiethane-2,1-diyl)bis[4-amino-N-(2-methylpropyl)benzenesulfonamide]	B	3BGB	0.72
IDM	INDOLINE	A,B	3CEP	0.85
IDM	INDOLINE	A	1AEK	0.85
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C73	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	1S2Y	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C75	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C76	0.71
RSA	N-PROPARGYL-1(S)-AMINOINDAN	A,B	2C72	0.71
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A	1S6R	0.71
IAP	4-IODO-ACETAMIDO PHENYLBORONIC ACID	A,B	1K6S	0.71
GA0	GLYCYLALANYL-N-2-NAPHTHYL-L-PROLINEAMIDE	A	2DCM	0.74
566	(3S)-1-CYCLOHEXYL-5-OXO-N-PHENYLPYRROLIDINE-3-CARBOXAMIDE	A	2H7I	0.73
264	(phenylamino)acetonitrile	A	2RBN	0.84
PL0	1-phenylguanidine	A	2O8W	0.73
9AP	9-AMINOPHENANTHRENE	A	1EGY	0.71
UFO	1-(1,4-dimethyl-1,2,3,4-tetrahydroquinoxalin-6-yl)methanamine	A,B,D	3GQT	0.86
DBP	1,3-DIAMINOBENZYL PHENYLALANINE	A	1A85	0.82
34T	(3R)-8-(dioxidosulfanyl)-3-methyl-1,2,3,4-tetrahydroquinoline	H	1ETR	0.72
1PC	1-(PHENYL-1-CYCLOHEXYL)PIPERIDINE	B,C	2PCP	0.71
A8B		A	1ODC	0.79
AFF	2-ACETYLAMINOFLUORENE-3-YL	A	2GE2	0.77
B2Y	1-biphenyl-2-ylmethanamine	A,B,C,D	3CCB	0.71
BEP	1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE	C	1LXF	0.78
BEP	1-ISOBUTOXY-2-PYRROLIDINO-3[N-BENZYLANILINO] PROPANE	A	1DTL	0.78
XYD	2,5-DIMETHYLANILINE	A,B,C,D	1KYA	0.76
XYD	2,5-DIMETHYLANILINE	A	1L4L	0.76
BNF	N-BENZYLFORMAMIDE	A,B	1U3U	0.71
SC5	2-[((R)-{[4-(AMINOMETHYL)PHENYL]AMINO}{[(1R)-1-PHENYLETHYL]AMINO}METHYL)AMINO]ETHANE-1,1-DIOL	H	1YNK	0.76
1MR	N-METHYLANILINE	X	2OTZ	0.81
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QJU	0.88
DSM	3-(10,11-DIHYDRO-5H-DIBENZO[B,F]AZEPIN-5-YL)-N-METHYLPROPAN-1-AMINE	A	2QB4	0.88
LJH	N,N'-(iminodiethane-2,1-diyl)bis(4-amino-N-benzylbenzenesulfonamide)	A,B	3BGC	0.76
AU4	4,4'-(AMINOMETHYLENE)BIS(N,N-DIMETHYLANILINE)	A	2PYZ	0.88
11X	N-(pyridin-3-ylmethyl)aniline	A	3EJ0	0.72
NP1	N-(3-AMINOPROPYL)-4-METHYL-2-NITROBENZENAMINE	A	1WUG	0.81
IDI	7-IODO-1,2,3,4-TETRAHYDRO-ISOQUINOLINE	A,B	1N7J	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	E,F,G,H	1NJU	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	Y,Z	1JQ7	0.71
BAS	N-(1-PHENYL-PROPYL)-FORMAMIDE	C	1NKM	0.71