Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02351765
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 |
HE7 | 4-{[(14beta,17alpha)-3-hydroxyestra- 1,3,5(10)-trien-17-yl]oxy}-4-oxobutanoic acid | A,B,C,D | 2Z77 | 0.72 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.72 | |
OST | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.78 | |
TTB | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.73 | |
MAX | MATAIRESINOL | A | 2BGM | 0.71 | |
DIC | 3,4-DICHLOROISOCOUMARIN | A | 1DIC | 0.74 | |
184 | 6-[HYDROXY-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTALEN-2- YL)-METHYL]-NAPHTALENE-2-CARBOXYLIC ACID | A | 1FCX | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.72 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.72 | |
ENM | (5S,8R,9S,10S,13R,14S,17S)-13-{2- [(3,5-DIFLUOROBENZYL)OXY]ETHYL}- 17-HYDROXY-10-METHYLHEXADECAHYDRO- 3H-CYCLOPENTA[A]PHENANTHREN-3-ONE | A | 2PNU | 0.74 | |
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 | 0.7 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A,B | 1C1X | 0.7 | |
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 | 0.7 | |
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 | 0.7 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1QRP | 0.7 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | A | 2CTC | 0.7 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E82 | 0.7 | |
HFA | ALPHA-HYDROXY-BETA-PHENYL-PROPIONIC ACID | I | 1E81 | 0.7 | |
4MA | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.73 | |
156 | 4-[3-OXO-3-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-NAPHTHALEN-2- YL)-PROPENYL]-BENZOIC ACID | A | 1FCZ | 0.73 | |
S1A | SORAPHEN A | A,B | 3GID | 0.72 | |
S1A | SORAPHEN A | A,B,C | 1W96 | 0.72 | |
UIN | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.72 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | |
PHT | PHTHALIC ACID | A,B,C | 2B7P | 0.72 | |
PHT | PHTHALIC ACID | A | 3C2V | 0.72 | |
PHT | PHTHALIC ACID | A,B,C,D,E,F | 1QPR | 0.72 | |
PHT | PHTHALIC ACID | A,B | 3C2R | 0.72 | |
LLG | 2-aminoethyl naphthalen-1-ylacetate | A | 3BC4 | 0.72 | |
NIU | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.72 | |
NPS | (2S)-2-(6-methoxynaphthalen-2-yl)propanoic acid | A | 2VDB | 0.74 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | |
FBC | A,B | 2B9A | 0.72 | ||
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A | 1MVC | 0.8 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A,C,E,G | 1MZN | 0.8 | |
OX1 | H,Y | 1LO2 | 0.73 | ||
BFL | A,B | 1Q4G | 0.72 | ||
ODE | DIETHYL (1R,2S,3R,4S)-5,6-BIS(4- HYDROXYPHENYL)-7-OXABICYCLO[2.2.1]HEPT- 5-ENE-2,3-DICARBOXYLATE | A,B | 2QH6 | 0.73 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.74 | |
NLA | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.74 | |
1NH | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.72 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.72 | |
BYS | 2-BENZO[1,3]DIOXOL-5-YLMETHYL-3- BENZYL-SUCCINIC ACID | A,B | 1JJE | 0.71 | |
OSB | 2-SUCCINYLBENZOATE | A | 1FHV | 0.75 | |
OSB | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.75 | |
OSB | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.75 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MRA | 0.71 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MNS | 0.71 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1DTN | 0.71 | |
APG | ATROLACTIC ACID (2-PHENYL-LACTIC ACID) | A | 1MDR | 0.71 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.75 | |
NDD | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.75 | |
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 | |
4FC | A | 1YSG | 0.73 | ||
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.81 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.71 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.71 | |
26C | A,B | 2F7I | 0.72 | ||
L79 | (S)-(2E)-3[4-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRO-2-NAPHTHALENYL)TETRAHYDRO- 1-BENZOFURAN-2-YL]-2-PROPENOIC ACID | A,D | 1RDT | 0.78 |