Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00008488
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 |
NRO | 3-[5-(2-nitropent-1-en-1-yl)furan- 2-yl]benzoic acid | A,B | 2ZK5 | 0.72 | |
B23 | 5-(2-NITROPHENYL)-2-FUROIC ACID | A | 2Q92 | 0.8 | |
D27 | 2-{[(2E)-3-(3,4-dimethoxyphenyl)prop- 2-enoyl]amino}benzoic acid | A,B,C,D | 2VD0 | 0.76 | |
R2C | 5-METHOXY-2-[(4-PHENOXYPHENYL)AMINO]BENZOIC ACID | A | 2PRL | 0.73 | |
DMB | A,B | 1SRI | 0.7 | ||
HNA | 1,8-DI-HYDROXY-4-NITRO-ANTHRAQUINONE | A | 1M2P | 0.71 | |
DPA | A,B | 1PIK | 0.75 | ||
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.7 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.7 | |
RDE | 2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE | A,B | 2FYP | 0.73 | |
RDE | 2-(3-AMINO-2,5,6-TRIMETHOXYPHENYL)ETHYL 5- CHLORO-2,4-DIHYDROXYBENZOATE | A | 1ZWH | 0.73 | |
HAB | A,B | 1SRE | 0.72 | ||
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.77 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A,B,C,D | 2AHC | 0.72 | |
VNL | 4-HYDROXY-3-METHOXYBENZOATE | A | 1XLR | 0.72 | |
VXX | VANILLATE | A,B | 1WB6 | 0.73 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.72 | |
FNG | 5-AMINOCARBONYL-3-NITROPHENYL-ALPHA- D-GALACTOPYRANOSE | D,E,F,G,H | 1LLR | 0.77 | |
MR2 | 3-DIPHENOL-6-NITRO-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSM | 0.72 | |
9AR | 9-HYDROXY ARISTOLOCHIC ACID | A,B | 1FV0 | 0.78 | |
194 | 4-{2-[(3-NITROBENZOYL)AMINO]PHENOXY}PHTHALIC ACID | A | 1Z6P | 0.71 | |
MOB | A,B | 1SRH | 0.83 | ||
MHB | A,B | 1SRG | 0.72 | ||
OXI | OXOLINIC ACID | A,B | 1KSE | 0.76 | |
A05 | 5-(2-CHLORO-4-NITROPHENYL)-2-FUROIC ACID | A | 2Q95 | 0.72 | |
ACJ | 5-[2-CHLORO-4-(TRIFLUOROMETHYL)PHENOXY]- 2-NITROBENZOIC ACID | A,B | 2IVD | 0.76 |