Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01724741
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 |
FL2![]() | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.72 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.75 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.75 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.75 | ![]() |
791![]() | 2-PHENYLMALONIC ACID | A | 1O4P | 0.72 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IPW | 0.8 | ![]() |
2CL![]() | (2,6-DICHLOROPHENYL)ACETIC ACID | A | 2IS7 | 0.8 | ![]() |
TRZ![]() | TRAZEOLIDE | A | 1C12 | 0.76 | ![]() |
FE3![]() | 4-(2-aminoethyl)-3-chlorobenzoic acid | A,B | 2K1Q | 0.71 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.76 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.76 | ![]() |
TTB![]() | 4-[(1E)-2-(5,5,8,8-TETRAMETHYL- 5,6,7,8-TETRAHYDRONAPHTHALEN-2- YL)PROP-1-ENYL]BENZOIC ACID | A | 1XAP | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1BXG | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1TOG | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1V2F | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1AHX | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A | 1TOI | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A | 1TOJ | 0.7 | ![]() |
BNA![]() | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | I | 4ER1 | 0.73 | ![]() |
BNA![]() | BIS-(NAPHTHYL-1-METHYL) ACETIC ACID | A | 1FQ5 | 0.73 | ![]() |
34Z![]() | 3,4-dichlorobenzoate | X | 2QVY | 0.71 | ![]() |
34Z![]() | 3,4-dichlorobenzoate | X | 2QW0 | 0.71 | ![]() |
BIP![]() | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.7 | ![]() |
174![]() | 4-CHLORO-BENZOIC ACID | X | 3DLP | 0.73 | ![]() |
174![]() | 4-CHLORO-BENZOIC ACID | X | 1T5D | 0.73 | ![]() |
FLP![]() | FLURBIPROFEN | A,B,C,D | 3PGH | 0.75 | ![]() |
FLP![]() | FLURBIPROFEN | A,B | 1CQE | 0.75 | ![]() |
FLP![]() | FLURBIPROFEN | A,B | 1EQH | 0.75 | ![]() |
FLP![]() | FLURBIPROFEN | A,B | 2AYL | 0.75 | ![]() |
FLP![]() | FLURBIPROFEN | A | 1DVT | 0.75 | ![]() |
FLP![]() | FLURBIPROFEN | A | 1R9O | 0.75 | ![]() |
IBP![]() | IBUPROFEN | A | 3FKX | 0.77 | ![]() |
IBP![]() | IBUPROFEN | A,B | 2BXG | 0.77 | ![]() |
IBP![]() | IBUPROFEN | A,B | 1EQG | 0.77 | ![]() |
IBP![]() | IBUPROFEN | A,B,C | 2WD9 | 0.77 | ![]() |
IBP![]() | IBUPROFEN | A | 2PWS | 0.77 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVZ | 0.73 | ![]() |
3BZ![]() | 3-chlorobenzoate | X | 2QVX | 0.73 | ![]() |
973![]() | (5Z)-3-(4-CHLOROPHENYL)-4-HYDROXY- 5-(1-NAPHTHYLMETHYLENE)FURAN-2(5H)- ONE | A | 2Q85 | 0.73 | ![]() |
PPT![]() | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.71 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.71 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.7 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.7 | ![]() |
PAC![]() | 2-PHENYLACETIC ACID | B | 1PNL | 0.73 | ![]() |
PAC![]() | 2-PHENYLACETIC ACID | B | 1K5Q | 0.73 | ![]() |
PAC![]() | 2-PHENYLACETIC ACID | B | 1FXH | 0.73 | ![]() |
PAC![]() | 2-PHENYLACETIC ACID | A | 2ISF | 0.73 | ![]() |
PAC![]() | 2-PHENYLACETIC ACID | A | 2INE | 0.73 | ![]() |
5PV![]() | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.71 | ![]() |
BFL![]() | A,B | 1Q4G | 0.77 | ![]() | |
HSI![]() | (3R)-3-{4-[(4-CHLOROPHENYL)ETHYNYL]BENZOYL}NONANOIC ACID | A | 2Z2D | 0.78 | ![]() |
AFI![]() | 2-[4-(4-CHLOROPHENYL)CYCLOHEXYLIDENE]- 3,4-DIHYDROXY-1(2H)-NAPHTHALENONE | A,B | 1UUM | 0.72 | ![]() |
DFA![]() | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.77 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.7 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.7 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.7 | ![]() |
AN1![]() | 3-(10-METHYL-ANTHRACEN-9-YL)-PROPIONIC ACID | H,Y | 1LO3 | 0.73 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.71 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.71 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.71 | ![]() |