Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02853914
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 |
4NB | 4-NITROBENZOIC ACID | A,B | 3CHT | 0.8 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1F42 | 0.77 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 1RXE | 0.77 | |
MNB | 5-MERCAPTO-2-NITRO-BENZOIC ACID | A | 2PER | 0.77 | |
GBS | 4-GUANIDINOBENZOIC ACID | X | 2AH4 | 0.76 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1GBT | 0.76 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 1RTK | 0.76 | |
GBS | 4-GUANIDINOBENZOIC ACID | A | 3DFL | 0.76 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D,E,F, G,H | 1F8S | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | E,I | 1ZFP | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2HU8 | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 1AN9 | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2GVQ | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2YR6 | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,I | 1E8N | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 1ZYK | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A | 1C0I | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B | 2JB3 | 0.81 | |
BE2 | 2-AMINOBENZOIC ACID | A,B,C,D | 2E4A | 0.81 | |
EAB | (3-{(E)-[3-(AMINOMETHYL)PHENYL]DIAZENYL}PHENYL)ACETIC ACID | A,B | 2H3T | 0.73 | |
AHC | 4-AMINOHYDROCINNAMIC ACID | A,B | 2AY1 | 0.74 | |
3B4 | 2-(cyclohexylamino)benzoic acid | A,B | 3B4P | 0.71 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C,D,E,F | 2PQF | 0.82 | |
GAB | 3-AMINOBENZOIC ACID | A,B | 3GSB | 0.82 | |
GAB | 3-AMINOBENZOIC ACID | A,B,C | 1GBN | 0.82 | |
GAB | 3-AMINOBENZOIC ACID | A | 3FHB | 0.82 | |
F77 | 3-ETHYL-6-{[(4-FLUOROPHENYL)SULFONYL]AMINO}- 2-METHYLBENZOIC ACID | A | 2EA2 | 0.72 | |
A75 | 2-[(PHENYLSULFONYL)AMINO]-5,6,7,8- TETRAHYDRONAPHTHALENE-1-CARBOXYLIC ACID | A | 1YW8 | 0.72 | |
4A3 | 4-AMINO-3-HYDROXYBENZOIC ACID | A,B | 2HDR | 0.78 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.77 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.77 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.77 | |
FDI | 4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACID | A | 1B9S | 0.73 | |
A41 | 5-METHYL-2-[(PHENYLSULFONYL)AMINO]BENZOIC ACID | A | 1YW7 | 0.77 | |
3AB | 3-aminobenzamide | A,B,C,D | 3GOY | 0.71 | |
4MB | 4-[(METHYLSULFONYL)AMINO]BENZOIC ACID | A,B | 2HDS | 0.84 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B | 1KDG | 0.7 | |
EMT | 2-(ETHYLMERCURI-THIO)-BENZOIC ACID | A,B,C,D | 1O9L | 0.7 | |
IBR | A | 9EST | 0.73 | ||
KY1 | 4-(2-AMINOPHENYL)-4-OXOBUTANOIC ACID | A,B,C,D | 2CH2 | 0.73 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A,B | 1BM7 | 0.7 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 1S2C | 0.7 | |
FLF | 2-[[3-(TRIFLUOROMETHYL)PHENYL]AMINO] BENZOIC ACID | A | 2PIX | 0.7 |