Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02349474
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 |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.73 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A | 1NX3 | 0.7 | |
ISA | 3-(4-IODO-PHENYL)-2-MERCAPTO-PROPIONIC ACID | A,B | 1ALW | 0.7 | |
M5P | (S)-2-(MERCAPTOMETHYL)-5-PHENYLPENTANOIC ACID | A,B | 2YZ3 | 0.7 | |
PTF | [(METHYLSULFANYL)METHYL]BENZENE | C,F | 1RHQ | 0.73 | |
IOB | 3-IODO-BENZYL ALCOHOL | A,B | 1QK0 | 0.71 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.76 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0D | 0.81 | |
PEL | 2-PHENYL-ETHANOL | D,H | 2I0T | 0.81 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1HZY | 0.81 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1I0B | 0.81 | |
PEL | 2-PHENYL-ETHANOL | A | 1EYW | 0.81 | |
PEL | 2-PHENYL-ETHANOL | A,B | 1JGM | 0.81 | |
CPM | S-(2-CARBOXY-3-PHENYLPROPYL)THIODIIMINE- S-METHANE | A | 1CPS | 0.73 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.7 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.8 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.8 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.8 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,5,9, A,B,C,H,J,K, L,M,N,O,Q,R, S,T,U,Y,Z | 1VQ6 | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,3,4,9,A, B,C,D,F,H,J, K,L,M,N,O,Q, R,S,T,U,Y,Z | 1VQP | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | 0,1,2,3,4,5, 9,A,B,C,D,F, H,J,K,L,M,N, O,Q,R,S,T,U, Y,Z | 1VQN | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.72 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.72 | |
PMS | BENZYLSULFINIC ACID | B | 1PNM | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1SH7 | 0.72 | |
PMS | BENZYLSULFINIC ACID | B,C | 1BB0 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1S2N | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WB8 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B,C | 3CE4 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1Y9Z | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 3H18 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 3H17 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 2CBG | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 1SUP | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1V6C | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1WPR | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1EQ9 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A,B | 1AUR | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 1KLT | 0.72 | |
PMS | BENZYLSULFINIC ACID | B,C | 1CA8 | 0.72 | |
PMS | BENZYLSULFINIC ACID | A | 2GKO | 0.72 | |
PMS | BENZYLSULFINIC ACID | B,C,D | 1BA8 | 0.72 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.73 | |
4FA | 4-FLUOROPHENETHYL ALCOHOL | A | 1OWZ | 0.78 | |
MXN | (2R)-hydroxy(phenyl)ethanenitrile | A,B | 3GDN | 0.73 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPM | 0.72 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPL | 0.72 | |
BTP | 2-THIOMETHYL-3-PHENYLPROPANOIC ACID | A,B | 1JAO | 0.71 | |
CGT | CARBA-GLUCOTROPAEOLIN | M | 1W9B | 0.72 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.8 | |
256 | PHENYL(SULFO)ACETIC ACID | A | 1O4Q | 0.77 | |
PPP | 3-PHENYL-1,2-PROPANDIOL | A,B | 1HRN | 0.83 | |
MNN | (S)-MANDELIC ACID NITRILE | A | 1YB6 | 0.73 |