Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01736254
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 |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.77 | |
789 | 3-BROMO-6-HYDROXY-2-(4-HYDROXYPHENYL)- 1H-INDEN-1-ONE | A,B | 1ZAF | 0.71 | |
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 | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.73 | |
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 | 0.73 | |
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 | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.73 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.73 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.7 | |
DPH | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.7 | |
BFL | A,B | 1Q4G | 0.71 | ||
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPM | 0.71 | |
OPH | 2-HYDROXY-3-PHENYL-PROPIONIC ACID METHYL ESTER | E,I | 1PPL | 0.71 | |
295 | (2S,3S)-3-(4-fluorophenyl)-2,3- dihydroxypropanoic acid | A,B | 2RJR | 0.76 | |
BRB | PARA-BROMOBENZYL ALCOHOL | A,B | 1HLD | 0.8 | |
SS1 | 1-PHENYLETHANOL | H | 1UM5 | 0.74 | |
12M | (2-ETHYLPHENYL)METHANOL | A,B | 2F62 | 0.71 | |
NDH | (1R, 2S)-CIS 1,2 DIHYDROXY-1,2- DIHYDRONAPHTHALENE | A,B | 1O7P | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.72 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.72 | |
KPV | 5-PHENYL-2-KETO-VALERIC ACID | A,B | 2Q5Q | 0.7 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.7 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.7 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.7 | |
DBE | bis(4-hydroxyphenyl)methanone | A | 2VKU | 0.7 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
791 | 2-PHENYLMALONIC ACID | A | 1O4P | 0.71 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B | 2TPL | 0.71 | |
HPP | HYDROXYPHENYL PROPIONIC ACID | A,B,C,D | 3GGP | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.77 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.77 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.7 | |
PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.7 | |
PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.7 | |
PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.7 | |
PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.7 | |
LJ3 | 3,5-dibromobiphenyl-4-ol | A,B | 3CN2 | 0.72 | |
269 | (1R)-3-chloro-1-phenylpropan-1- ol | A | 2RBS | 0.7 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZK0 | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJZ | 0.74 | |
SS2 | (1R)-1-PHENYLETHANOL | A | 1ZJY | 0.74 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.71 | |
GRO | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.71 | |
LJ2 | 2,6-dibromo-4-[(E)-2-phenylethenyl]phenol | A,B | 3CN1 | 0.71 |