Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00021262
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 |
BFL | A,B | 1Q4G | 0.71 | ||
2PM | N-[2-(BENZHYDRYLOXY)ETHYL]-N,N- DIMETHYLAMINE | A,B | 2AOT | 0.73 | |
BZM | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.85 | |
PAC | 2-PHENYLACETIC ACID | B | 1PNL | 0.71 | |
PAC | 2-PHENYLACETIC ACID | B | 1K5Q | 0.71 | |
PAC | 2-PHENYLACETIC ACID | B | 1FXH | 0.71 | |
PAC | 2-PHENYLACETIC ACID | A | 2ISF | 0.71 | |
PAC | 2-PHENYLACETIC ACID | A | 2INE | 0.71 | |
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 | 0.72 | |
BM6 | 4-[2-(5,5,8,8-TETRAMETHYL-5,6,7,8- TETRAHYDRO-NAPHTHALEN-2-YL)-[1,3]DIOXOLAN- 2-YL]-BENZOIC ACID | A,C,E,G | 1MZN | 0.72 | |
FL2 | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.74 | |
GRR | (2S)-2-(4-ethylphenoxy)-3-phenylpropanoic acid | A | 3CDS | 0.71 | |
S1A | SORAPHEN A | A,B | 3GID | 0.72 | |
S1A | SORAPHEN A | A,B,C | 1W96 | 0.72 | |
1NH | (2E,6E)-8-[(3-BENZOYLBENZYL)OXY]- 3,7-DIMETHYLOCTA-2,6-DIENYL TRIHYDROGEN DIPHOSPHATE | B | 1O1S | 0.73 | |
4CB | 4-CARBOXYPHENYLBORONIC ACID | A,B | 1KDW | 0.71 | |
RMN | (R)-MANDELIC ACID | A | 1MDL | 0.71 | |
RMN | (R)-MANDELIC ACID | A,B,C,D,E,F, G,H,I,J,K,L, M,N,O,P | 1MCZ | 0.71 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | |
CIN | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | |
OFF | 2-DEOXY-3,4-BIS-O-[3-(4-HYDROXYPHENYL)PROPANOYL]- L-THREO-PENTARIC ACID | A | 2OFF | 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 | |
SEM | 3-AMINO-4-OXYBENZYL-2-BUTANONE | A,B | 1THE | 0.7 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTH | 0.72 | |
OBZ | O-benzylhydroxylamine | A,B | 3DTG | 0.72 | |
SMN | (S)-MANDELIC ACID | A | 1MDL | 0.71 | |
MX4 | {1-[4-(BENZYLOXY)-4-OXOBUTANOYL]HYDRAZINO}ACETIC ACID | I | 2C2M | 0.71 | |
HZ3 | dimethyl (1R,4S)-5,6-bis(4-hydroxyphenyl)- 7-oxabicyclo[2.2.1]hepta-2,5-diene- 2,3-dicarboxylate | A,B | 2QR9 | 0.7 | |
OST | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.79 | |
OX1 | H,Y | 1LO2 | 0.72 | ||
TB1 | (3S)-3-(BENZYLOXY)-L-ASPARTIC ACID | A,B,C | 2NWW | 0.71 | |
DFA | DIPHENYLACETIC ACID | A,B,C | 1GMY | 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 | 0.72 | |
BGG | CARBONIC ACID MONOBENZYL ESTER | B,D | 1DLK | 0.81 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2F4O | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJO | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CDR | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C1E | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 5PAD | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1JXQ | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 2CNO | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1CGL | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ9 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2K | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 2CNL | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KJP | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2M | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZB | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 9HVP | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1ESB | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,F | 1DY8 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 1PPM | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 1GEC | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KS7 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | C | 1A8G | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KKK | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | T,U,V,W,X,Y | 1QDU | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 4TMN | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5TMN | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KTO | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,C | 1TG1 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2AZ8 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 2G58 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | Q,R,S,T,U,V | 1F9E | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CJY | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,I | 1E8M | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KR6 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 6TMN | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KRO | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNN | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2C2O | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1SQZ | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A,B | 1THE | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I,J | 2AZC | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | E,I | 5EST | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 2CNK | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | A | 1KL6 | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | I | 6PAD | 0.82 | |
PHQ | FORMIC ACID BENZYL ESTER | B,I | 2C2Z | 0.82 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.72 | |
BZS | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.72 | |
BZS | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.72 | |
RSO | R-STYRENE OXIDE | A,B | 1PWZ | 0.76 |