Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03425857
You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.
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 |
NPC | 4-HYDROXY-3-NITROPHENYLACETYL-EPSILON- AMINOCAPROIC ACID ANION | H,I,J | 1A6V | 0.73 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.73 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.73 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.73 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.75 | |
NIP | 4-HYDROXY-5-IODO-3-NITROPHENYLACETYL- EPSILON-AMINOCAPROIC ACID ANION | H | 1A6W | 0.7 | |
DNT | 2-[1-METHYLHEXYL]-4,6-DINITROPHENOL | A,B,C | 1NEN | 0.71 | |
C00 | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BYX | 0.79 | |
C00 | 2-(4-hydroxybiphenyl-3-yl)-4-methyl- 1H-isoindole-1,3(2H)-dione | A | 3BZ0 | 0.79 | |
DZ1 | N-(3,5-dibromo-4-hydroxyphenyl)- 2,6-dimethylbenzamide | A,B | 3ESN | 0.71 | |
MRE | 2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACID | A,B | 2V9C | 0.73 | |
NPA | 2-(4-HYDROXY-3-NITROPHENYL)ACETIC ACID | H | 1NGP | 0.77 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A | 1DSR | 0.71 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | |
D4P | (2S)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | |
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 | |
NIY | META-NITRO-TYROSINE | A | 2ADP | 0.75 | |
NIY | META-NITRO-TYROSINE | A | 3DIV | 0.75 | |
NIY | META-NITRO-TYROSINE | A | 2H5U | 0.75 | |
NIY | META-NITRO-TYROSINE | A | 1K4Q | 0.75 | |
NIY | META-NITRO-TYROSINE | B,G,O,Y | 1SDA | 0.75 | |
AC6 | P-HYDROXYACETOPHENONE | A | 2GQ8 | 0.74 | |
AC6 | P-HYDROXYACETOPHENONE | X | 2O48 | 0.74 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3S | 0.7 | |
ZAB | (3-{(Z)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B,C,D | 2H4B | 0.7 | |
135 | N-(4-CARBAMIMIDOYL-PHENYL)-2-HYDROXY- BENZAMIDE | B | 1GJA | 0.73 | |
ST2 | 4-(ACETYLAMINO)-5-AMINO-3-HYDROXYBENZOIC ACID | A,B | 1IVC | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1PBD | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | B | 2DZA | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUS | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUU | 0.71 | |
PAB | 4-AMINOBENZOIC ACID | A | 1IUT | 0.71 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6Y | 0.74 | |
TYQ | 3-AMINO-6-HYDROXY-TYROSINE | A,B | 1D6U | 0.74 | |
1BA | 4-HYDROXY-N'-(4-ISOPROPYLBENZYL)BENZOHYDRAZIDE | A | 2GPP | 0.74 | |
BRK | {(2Z)-4-AMINO-2-[(4-METHOXYPHENYL)IMINO]- 2,3-DIHYDRO-1,3-THIAZOL-5-YL}(4- METHOXYPHENYL)METHANONE | A | 2IZR | 0.71 | |
MTB | A,B | 1SRF | 0.84 | ||
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.7 | |
SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.7 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.7 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.7 | |
SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.7 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.7 | |
MNX | 1,8-DI-HYDROXY-4-NITRO-XANTHEN- 9-ONE | A | 1M2Q | 0.7 | |
FEN | N-(4-HYDROXYPHENYL)ALL-TRANS RETINAMIDE | A | 1FEL | 0.71 | |
AZY | 3-AZIDO-L-TYROSINE | A | 2YXN | 0.81 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.78 | |
2TY | 2-HYDROXY-5-{[(1E)-2-PHENYLETHYLIDENE]AMINO}- L-TYROSINE | A,B | 2CWV | 0.74 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.77 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.77 | |
709 | N-(7-CARBAMIMIDOYL-NAPHTHALEN-1- YL)-3-HYDROXY-2-METHYL-BENZAMIDE | A | 1ZSJ | 0.7 | |
MHB | A,B | 1SRG | 0.84 | ||
BIA | 1-(3,4,DIHYDROXY-5-NITROPHENYL)- 3-{4-[3-(TRIFLUOROMETHYL) PHENYL] PIPERAZIN- 1-YL}PROPAN-1-ONE | A | 1H1D | 0.72 | |
NAB | A,B | 1SRJ | 0.79 | ||
NU1 | 8-HYDROXY-2-METHYL-3-HYDRO-QUINAZOLIN- 4-ONE | A | 4PAX | 0.71 | |
OPB | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A | 1Q7A | 0.71 | |
OPB | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A,B | 2BXB | 0.71 | |
OPB | 4-BUTYL-1-(4-HYDROXYPHENYL)-2-PHENYLPYRAZOLIDINE- 3,5-DIONE | A | 2BXO | 0.71 | |
LI7 | (3E)-3-[(4-HYDROXYPHENYL)IMINO]- 1H-INDOL-2(3H)-ONE | A | 1YXX | 0.71 | |
TY2 | 3-AMINO-L-TYROSINE | A,B | 2VH3 | 0.81 | |
U14 | 3-(5-AMINO-3-IMINO-3H-PYRAZOL-4- YLAZO)-BENZOIC ACID | A | 2GG7 | 0.72 | |
2AF | 2-AMINOPHENOL | A | 1L4N | 0.7 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.74 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.71 | |
DGH | (2R)-AMINO(4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.71 | |
HAB | A,B | 1SRE | 0.83 | ||
DMB | A,B | 1SRI | 0.82 | ||
968 | 2-[(7-HYDROXY-NAPHTHALEN-1-YL)- OXALYL-AMINO]-BENZOIC ACID | A | 1ONZ | 0.71 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.7 | |
2AC | 2-AMINO-P-CRESOL | H,I | 1A2C | 0.78 | |
2AC | 2-AMINO-P-CRESOL | A | 1L4M | 0.78 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.74 | |
GHP | 4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.71 | |
MOY | [(4R)-4-(3-HYDROXYPHENYL)-1,6-DIMETHYL- 2-THIOXO-1,2,3,4-TETRAHYDROPYRIMIDIN- 5-YL](PHENYL)METHANONE | A,B | 2IEH | 0.71 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.75 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.75 | |
LJ5 | N-(3,5-dibromo-4-hydroxyphenyl)benzamide | A,B | 3CN4 | 0.72 | |
NCR | 2-NITRO-P-CRESOL | A,B | 1AHV | 0.75 | |
HNA | 1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE | A | 1M2P | 0.73 | |
DMC | 3-(4-DIETHYLAMINO-2-HYDROXY-PHENYL)- 2-METHYL-PROPIONIC ACID | G | 4GCH | 0.7 | |
MNY | 5,8-DI-AMINO-1,4-DIHYDROXY-ANTHRAQUINONE | A | 1M2R | 0.74 |