Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02372248
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 |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5U | 0.77 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 3E6B | 0.77 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B,C,D | 3E5X | 0.77 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | A,B | 2H6B | 0.77 | |
3C4 | (3-CHLORO-4-HYDROXYPHENYL)ACETIC ACID | C | 3E6C | 0.77 | |
NP4 | (5Z)-12-CHLORO-13,15-DIHYDROXY- 4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE- 1,10(3H,11H)-DIONE | A | 2IWS | 0.73 | |
3BZ | 3-chlorobenzoate | X | 2QVZ | 0.7 | |
3BZ | 3-chlorobenzoate | X | 2QVX | 0.7 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.71 | |
IFA | A,B | 3FC8 | 0.71 | ||
DIU | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A,B | 3B56 | 0.72 | |
DIU | 2-HYDROXY-3,5-DIIODO-BENZOIC ACID | A | 2BXL | 0.72 | |
P2N | (5Z)-13-CHLORO-14,16-DIHYDROXY- 3,4,7,8,9,10-HEXAHYDRO-1H-2-BENZOXACYCLOTETRADECINE- 1,11(12H)-DIONE | A | 2CGF | 0.73 | |
CHP | 3-CHLORO-4-HYDROXYPHENYLGLYCINE | A | 1DSR | 0.77 | |
A15 | 3'-3"-DICHLOROPHENOL-1,8-3H-BENZO[DE]ISOCHROMEN- 1-ONE | A | 1TSL | 0.73 | |
BJH | 1(R)-1-ACETAMIDO-2-(3-CARBOXY-2- HYDROXYPHENYL)ETHYL BORONIC ACID | A | 1ERQ | 0.77 | |
SCL | ACETIC ACID SALICYLOYL-AMINO-ESTER | A | 1EBV | 0.71 | |
3CA | A,B | 2B77 | 0.84 | ||
IFB | N-[(2',4'-DIFLUORO-4-HYDROXY-5- IODOBIPHENYL-3-YL)CARBONYL]-BETA- ALANINE | A,B | 3FCB | 0.72 | |
BJP | (1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACID | A | 1ERO | 0.7 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I2Z | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C | 1FIQ | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 2I30 | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1PTH | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3DEU | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B,C,D | 2E1Q | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3HGX | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 3BPX | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1WYG | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 1JGS | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | X | 1M6E | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A | 3B9M | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1FO4 | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 1Y7I | 0.73 | |
SAL | 2-HYDROXYBENZOIC ACID | A,B | 2FN1 | 0.73 | |
FE3 | 4-(2-aminoethyl)-3-chlorobenzoic acid | A,B | 2K1Q | 0.77 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 2BXE | 0.76 | |
1FL | 5-(2,4-DIFLUOROPHENYL)-2-HYDROXY- BENZOIC ACID | A,B | 3D2T | 0.76 | |
CHB | 3-CHLORO-4-HYDROXYBENZOIC ACID | M,N,O,P,Q,R | 3PCH | 0.77 | |
G50 | 3-(4-HYDROXYPHENYL)-1-(2,4,6-TRIHYDROXYPHENYL)PROPAN- 1-ONE | A,B | 2UXI | 0.73 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3C3U | 0.83 | |
C2U | 3,5-dichloro-2-hydroxybenzoic acid | A | 3CV7 | 0.83 | |
NP5 | (5E)-12-CHLORO-13,15-DIHYDROXY- 4,7,8,9-TETRAHYDRO-2-BENZOXACYCLOTRIDECINE- 1,10(3H,11H)-DIONE | A | 2IWU | 0.73 | |
RDC | RADICICOL | A,B | 2Q8I | 0.71 | |
RDC | RADICICOL | A,B | 1U0Z | 0.71 | |
RDC | RADICICOL | A | 1BGQ | 0.71 | |
RDC | RADICICOL | B,D,F,H | 2ZBK | 0.71 | |
RDC | RADICICOL | A | 2HKJ | 0.71 | |
RDC | RADICICOL | A,B,C | 3CGY | 0.71 | |
RDC | RADICICOL | A,B | 2WER | 0.71 | |
DTY | D-TYROSINE | A | 1C4B | 0.7 | |
DTY | D-TYROSINE | A,L | 1ZEA | 0.7 | |
DTY | D-TYROSINE | A,B,C,D,E,F, G,H | 1OF6 | 0.7 | |
DTY | D-TYROSINE | A,B | 1UNO | 0.7 | |
DTY | D-TYROSINE | A | 2IGZ | 0.7 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5D | 0.7 | |
DTY | D-TYROSINE | A,B | 2Q33 | 0.7 | |
DTY | D-TYROSINE | H,S | 2H9E | 0.7 | |
DTY | D-TYROSINE | A,B,C,H,K,L | 2R5B | 0.7 | |
DTY | D-TYROSINE | A | 2IH0 | 0.7 | |
DTY | D-TYROSINE | A | 1D7T | 0.7 | |
DTY | D-TYROSINE | A,B | 1XA0 | 0.7 | |
HCC | 2',4,4'-TRIHYDROXYCHALCONE | D | 1FP1 | 0.73 | |
M1S | (5E)-14-CHLORO-15,17-DIHYDROXY- 4,7,8,9,10,11-HEXAHYDRO-2-BENZOXACYCLOPENTADECINE- 1,12(3H,13H)-DIONE | A | 2IWX | 0.73 | |
FHI | A,B | 1Y1D | 0.74 | ||
L1O | 4-(2-aminoethoxy)-3,5-dichlorobenzoic acid | A | 2VIO | 0.76 | |
ADL | (1,8-DIHYDROXY-9-OXO-9,10-DIHYDRO- ANTHRACEN-2-YL)-ACETIC ACID | A,B | 1N5S | 0.71 | |
OAL | (1,8-DIHYDROXY-9,10-DIOXO-9,10- DIHYDRO-ANTHRACEN-2-YL)-ACETIC ACID | B | 1N5T | 0.71 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAV | 0.72 | |
IH5 | [4-(4-HYDROXY-3-ISOPROPYLPHENOXY)- 3,5-DIMETHYLPHENYL]ACETIC ACID | A | 1NAX | 0.72 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5A | 0.75 | |
BIK | 3,7-DIHYDROXY-2-NAPHTHOIC ACID | A | 1U5C | 0.75 | |
CNT | N-METHYL-META-CHLORO-TYROSINE | C,D | 1OKX | 0.76 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 1G3M | 0.71 | |
PCQ | 3,5,3',5'-TETRACHLORO-BIPHENYL- 4,4'-DIOL | A,B | 2G5U | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOD | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1DOE | 0.71 | |
DOB | 2,4-DIHYDROXYBENZOIC ACID | A | 1PBB | 0.71 | |
GRE | 2,6-DIHYDROXYBENZOIC ACID | A,B,C,D | 2DVU | 0.71 | |
159 | 2-HYDROXY-5-(2-MERCAPTO-ETHYLSULFAMOYL)- BENZOIC ACID | A,B | 1NME | 0.72 |