MMsInc Molecule/ Ligand PDB

Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00601673

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.

Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
Ligand	Ligand name	Chain	PDB	Tanimoto	Ligand in PDB
ST6	4-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACID	A,B	1INH	0.7
LI7	(3E)-3-[(4-HYDROXYPHENYL)IMINO]- 1H-INDOL-2(3H)-ONE	A	1YXX	0.78
TYZ	PARA ACETAMIDO BENZOIC ACID	B,C	2BNI	0.73
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5K	0.73
TYZ	PARA ACETAMIDO BENZOIC ACID	A	1W5J	0.73
U14	3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID	A	2GG7	0.71
DZ1	N-(3,5-dibromo-4-hydroxyphenyl)- 2,6-dimethylbenzamide	A,B	3ESN	0.71
NU1	8-HYDROXY-2-METHYL-3-HYDRO-QUINAZOLIN- 4-ONE	A	4PAX	0.72
BE2	2-AMINOBENZOIC ACID	A,B,C,D,E,F, G,H	1F8S	0.71
BE2	2-AMINOBENZOIC ACID	E,I	1ZFP	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2HU8	0.71
BE2	2-AMINOBENZOIC ACID	A,B	1AN9	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2GVQ	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2YR6	0.71
BE2	2-AMINOBENZOIC ACID	A,I	1E8N	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	1ZYK	0.71
BE2	2-AMINOBENZOIC ACID	A	1C0I	0.71
BE2	2-AMINOBENZOIC ACID	A,B	2JB3	0.71
BE2	2-AMINOBENZOIC ACID	A,B,C,D	2E4A	0.71
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1W7Q	0.7
DGH	(2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H	1W7R	0.7
4MB	4-[(METHYLSULFONYL)AMINO]BENZOIC ACID	A,B	2HDS	0.71
136	N-(4-CARBAMIMIDOYL-3-CHORO-PHENYL)- 2-HYDROXY-3-IODO-5-METHYL-BENZAMIDE	B	1GJD	0.74
TY2	3-AMINO-L-TYROSINE	A,B	2VH3	0.75
SHA	SALICYLHYDROXAMIC ACID	X	1V0H	0.72
SHA	SALICYLHYDROXAMIC ACID	A	2QPK	0.72
SHA	SALICYLHYDROXAMIC ACID	A	3FNL	0.72
SHA	SALICYLHYDROXAMIC ACID	A	3GCJ	0.72
SHA	SALICYLHYDROXAMIC ACID	A	1CK6	0.72
HBD	4-HYDROXYBENZAMIDE	B,C,D	1BEN	0.76
SCL	ACETIC ACID SALICYLOYL-AMINO-ESTER	A	1EBV	0.71
GHP	4-HYDROXYPHENYLGLYCINE	A	1DSR	0.7
UA1	N-(TERT-BUTOXYCARBONYL)-L-TYROSYL- N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE	A	2I4H	0.7
UA1	N-(TERT-BUTOXYCARBONYL)-L-TYROSYL- N-METHYL-4-(SULFOAMINO)-L-PHENYLALANINAMIDE	A	2I4G	0.7
NPC	4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION	H,I,J	1A6V	0.72
MTB		A,B	1SRF	0.74
YOL	[[2,2'-[4-CARBOXY-1,2-PHENYLENEBIS(NITRILOMETHYLIDYNE)]BIS[PHENOLATO]](2- )-N,N',O,O']-IRON	A,B	1WZF	0.76
1BA	4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDE	A	2GPP	0.73
NIY	META-NITRO-TYROSINE	A	2ADP	0.7
NIY	META-NITRO-TYROSINE	A	3DIV	0.7
NIY	META-NITRO-TYROSINE	A	2H5U	0.7
NIY	META-NITRO-TYROSINE	A	1K4Q	0.7
NIY	META-NITRO-TYROSINE	B,G,O,Y	1SDA	0.7
MRE	2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID	A,B	2V9C	0.7
TYC	L-TYROSINAMIDE	A	2BF9	0.71
TYC	L-TYROSINAMIDE	A	2OCI	0.71
DMB		A,B	1SRI	0.75
3HA	3-HYDROXYANTHRANILIC ACID	A,B	1U1W	0.72
3HA	3-HYDROXYANTHRANILIC ACID	A	1YFY	0.72
2TY	2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}- L-TYROSINE	A,B	2CWV	0.74
GBS	4-GUANIDINOBENZOIC ACID	X	2AH4	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	1GBT	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	1RTK	0.7
GBS	4-GUANIDINOBENZOIC ACID	A	3DFL	0.7
GAB	3-AMINOBENZOIC ACID	A,B,C,D,E,F	2PQF	0.72
GAB	3-AMINOBENZOIC ACID	A,B	3GSB	0.72
GAB	3-AMINOBENZOIC ACID	A,B,C	1GBN	0.72
GAB	3-AMINOBENZOIC ACID	A	3FHB	0.72
LJ5	N-(3,5-dibromo-4-hydroxyphenyl)benzamide	A,B	3CN4	0.75
AZY	3-AZIDO-L-TYROSINE	A	2YXN	0.74
DZ3	N-(3,5-dibromo-4-hydroxyphenyl)- 4-hydroxy-3,5-dimethylbenzamide	A,B	3ESP	0.7
OX3	4-HYDROXYBENZALDEHYDE O-(CYCLOHEXYLCARBONYL)OXIME	A,B,C	2OOH	0.7
ST3	4-(ACETYLAMINO)-3-AMINO BENZOIC ACID	A,B	1IVE	0.7
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A	1DSR	0.7
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H	1W7R	0.7
D4P	(2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID	A,B,C,D,E,F, G,H,I,J,K,L	1W7Q	0.7
NAB		A,B	1SRJ	0.71
PAB	4-AMINOBENZOIC ACID	A	1PBD	0.74
PAB	4-AMINOBENZOIC ACID	B	2DZA	0.74
PAB	4-AMINOBENZOIC ACID	A	1IUS	0.74
PAB	4-AMINOBENZOIC ACID	A	1IUU	0.74
PAB	4-AMINOBENZOIC ACID	A	1IUT	0.74
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBC	0.76
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1PBF	0.76
BHA	2-HYDROXY-4-AMINOBENZOIC ACID	A	1SXK	0.76
3BE	3-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide	A,B,C,D,E,F	3DOZ	0.72
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3S	0.71
ZAB	(3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B,C,D	2H4B	0.71
MHB		A,B	1SRG	0.77
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A,B	2VJ1	0.72
XP1	4-(DIMETHYLAMINO)BENZOIC ACID	A	2V6N	0.72
3B4	2-(cyclohexylamino)benzoic acid	A,B	3B4P	0.7
CZM	'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE'	A	1J3F	0.76
CZM	'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE'	A	1UFJ	0.76
CZM	'N,N'-BIS-(2-HYDROXY-3-METHYL-BENZYLIDENE)- BENZENE-1,2-DIAMINE'	A	1V9Q	0.76
709	N-(7-CARBAMIMIDOYL-NAPHTHALEN-1- YL)-3-HYDROXY-2-METHYL-BENZAMIDE	A	1ZSJ	0.73
2AC	2-AMINO-P-CRESOL	H,I	1A2C	0.7
2AC	2-AMINO-P-CRESOL	A	1L4M	0.7
TIL	[2-[5-CARBOXYETHYL-2-PHENOLATO(NITRILOMETHYLIDYNE)][PHENOLATO]]CHROMIUM(III)	A,B	2Z68	0.73
YOK	[[2,2'-[4-CARBOXYETHYL-1,2-PHENYLENEBIS(NITRILOMETHYLIDYNE)]BIS[PHENOLATO]](2- )-N,N',O,O']-IRON	A,B	1WZD	0.71
EAB	(3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID	A,B	2H3T	0.71
135	N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY- BENZAMIDE	B	1GJA	0.82
4BE	4-bromo-N'-[(1E)-(3,5-dibromo-2,4- dihydroxyphenyl)methylidene]benzohydrazide	A,B,C,D,E,F	3DP2	0.72
HAB		A,B	1SRE	0.79
4A3	4-AMINO-3-HYDROXYBENZOIC ACID	A,B	2HDR	0.76