Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02458643
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 |
ECA | N,N',N''-[BENZENE-1,3,5-TRIYLTRIS(METHYLENE)]TRIS(2,3- DIHYDROXYBENZAMIDE) | A,B | 2CHU | 0.74 | |
HBD | 4-HYDROXYBENZAMIDE | B,C,D | 1BEN | 0.8 | |
D3P | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1W7Q | 0.74 | |
D3P | (2R)-AMINO(3,5-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D,E,F, G,H | 1W7R | 0.74 | |
DB1 | 2,3-DIHYDROXYBENZAMIDE | A,B,C | 1X71 | 0.89 | |
GRE | 2,6-DIHYDROXYBENZOIC ACID | A,B,C,D | 2DVU | 0.74 | |
PY9 | 4-{[(2R)-2-(2-methylphenyl)pyrrolidin- 1-yl]carbonyl}benzene-1,3-diol | A,B | 3EKR | 0.72 | |
SHA | SALICYLHYDROXAMIC ACID | X | 1V0H | 0.84 | |
SHA | SALICYLHYDROXAMIC ACID | A | 2QPK | 0.84 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3FNL | 0.84 | |
SHA | SALICYLHYDROXAMIC ACID | A | 3GCJ | 0.84 | |
SHA | SALICYLHYDROXAMIC ACID | A | 1CK6 | 0.84 | |
SYR | SYRINGATE | A,B | 1WB5 | 0.71 | |
23A | 2,3-DIHYDROXYBENZALDEHYDE | A,B,C,D | 2DVX | 0.75 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.81 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.77 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.77 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.77 | |
3XH | 3-Hydroxyhippuric acid | A | 3E9K | 0.7 | |
34D | 3,5-DIHYDROXYBENZOATE | A,B | 2BX7 | 0.73 | |
BIE | (3,4-DIHYDROXY-2-NITROPHENYL)(PHENYL)METHANONE | A,B | 2CL5 | 0.7 | |
BJH | 1(R)-1-ACETAMIDO-2-(3-CARBOXY-2- HYDROXYPHENYL)ETHYL BORONIC ACID | A | 1ERQ | 0.7 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBC | 0.72 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1PBF | 0.72 | |
BHA | 2-HYDROXY-4-AMINOBENZOIC ACID | A | 1SXK | 0.72 | |
G50 | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.71 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.71 | |
HCC | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.75 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BV0 | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B,D,F,H,J,L | 1YKP | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1N8Q | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A,B | 2BSL | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKL | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D | 1B4U | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 3DX5 | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCA | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B,D,F,H,J,L | 1YKN | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 1EOB | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | A | 1PHH | 0.76 | |
DHB | 3,4-DIHYDROXYBENZOIC ACID | B | 2BUV | 0.76 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ4 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOB | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXB | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1G1B | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1YKJ | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUV | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PBE | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCC | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PDH | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUW | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC4 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CC6 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUW | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1FW9 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1G81 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGJ | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1IUX | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ3 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1D7L | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 2PHH | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BGN | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXA | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1DOC | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1K0I | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BKW | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1JD3 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1PXC | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1TT8 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1CJ2 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A,B | 1Q4S | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | A | 1BF3 | 0.7 | |
PHB | P-HYDROXYBENZOIC ACID | B | 2BUR | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RH4 | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 3CSD | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RHR | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 1F0Q | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 3C13 | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A,B | 2RHC | 0.7 | |
EMO | 3-METHYL-1,6,8-TRIHYDROXYANTHRAQUINONE | A | 3BQC | 0.7 | |
FSE | 3,7,3',4'-TETRAHYDROXYFLAVONE | B | 1XO2 | 0.7 | |
DBS | 2-(2,3-DIHYDROXY-BENZOYLAMINO)- 3-HYDROXY-PROPIONIC ACID | A,B,C | 1L6M | 0.75 | |
DBS | 2-(2,3-DIHYDROXY-BENZOYLAMINO)- 3-HYDROXY-PROPIONIC ACID | A,B,C | 3CBC | 0.75 | |
DBS | 2-(2,3-DIHYDROXY-BENZOYLAMINO)- 3-HYDROXY-PROPIONIC ACID | A,B,C | 3BY0 | 0.75 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3CMP | 0.77 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MD9 | 0.77 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A | 1MDB | 0.77 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 1L6M | 0.77 | |
DBH | 2,3-DIHYDROXY-BENZOIC ACID | A,B,C | 3BY0 | 0.77 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | M,N,O,P,Q,R | 3PCN | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | B | 1AI4 | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B,C,D | 1Q0C | 0.71 | |
DHY | 2-(3,4-DIHYDROXYPHENYL)ACETIC ACID | A,B | 1F1V | 0.71 | |
FLV | FLAVIOLIN | A | 1ZDW | 0.73 | |
FLV | FLAVIOLIN | A | 1T93 | 0.73 | |
FLV | FLAVIOLIN | A | 2D09 | 0.73 |