Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00052042
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 |
DMB | A,B | 1SRI | 0.72 |  | |
BPN | PARANITROBENZYL ALCOHOL | H,L | 1YEG | 0.72 | |
HAB | A,B | 1SRE | 0.74 | | |
CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V97 | 0.71 | |
| CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V98 | 0.71 | |
| CFQ | 1-(2-nitrophenyl)-2,2,2-trifluoroethyl]- arsenocholine | A,B | 2V96 | 0.71 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.86 | |
| MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.86 | |
| MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.86 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.71 | |
AAN | 2-(4-NITROPHENYL)ACETIC ACID | B | 1AJN | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.83 | |
| BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.83 | |
3HA | 3-HYDROXYANTHRANILIC ACID | A,B | 1U1W | 0.72 | |
| 3HA | 3-HYDROXYANTHRANILIC ACID | A | 1YFY | 0.72 | |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.85 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.72 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.74 | |
| FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.74 | |
| FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.74 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.77 | |
| GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.77 | |
| GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.77 | |
| GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.77 | |
878 | 5-IODO-2-(OXALYL-AMINO)-BENZOIC ACID | A | 1ECV | 0.72 | |
MNP | 2-(3-NITROPHENYL)ACETIC ACID | B | 1AI5 | 0.78 | |
MHB | A,B | 1SRG | 0.72 | | |
B23 | 5-(2-NITROPHENYL)-2-FUROIC ACID | A | 2Q92 | 0.7 | |
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.73 | |
F77 | 3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID | A | 2EA2 | 0.71 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.72 | |