Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02634125
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 |
UIN![]() | 5,6,7,8,9,10-HEXAHYDRO-4-HYDROXY- 3-(1-PHENYLPROPYL)CYCLOOCTA[B]PYRAN- 2-ONE | B | 5UPJ | 0.75 | ![]() |
DIC![]() | 3,4-DICHLOROISOCOUMARIN | A | 1DIC | 0.73 | ![]() |
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 | 0.74 | ![]() |
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 | 0.74 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1K5S | 0.73 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1KEC | 0.73 | ![]() |
GRO![]() | R-2-PHENYL-PROPRIONIC ACID | B | 1K7D | 0.73 | ![]() |
OST![]() | METHYL (2Z)-3-METHOXY-2-{2-[(E)- 2-PHENYLVINYL]PHENYL}ACRYLATE | C,D,E | 1SQQ | 0.78 | ![]() |
FBC![]() | A,B | 2B9A | 0.71 | ![]() | |
5PV![]() | 5-PHENYLVALERIC ACID | A,B | 2AY9 | 0.72 | ![]() |
791![]() | 2-PHENYLMALONIC ACID | A | 1O4P | 0.7 | ![]() |
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 | 0.8 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A | 1OS0 | 0.72 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJI | 0.72 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2JJJ | 0.72 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 2VS2 | 0.72 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | A,B | 1OD1 | 0.72 | ![]() |
DPH![]() | DEAMINO-METHYL-PHENYLALANINE | E | 1EPR | 0.72 | ![]() |
LLG![]() | 2-aminoethyl naphthalen-1-ylacetate | A | 3BC4 | 0.71 | ![]() |
NOM![]() | 7-HYDROXY-5-METHYL-3,3A,5,11B-TETRAHYDRO- 1,4-DIOXA-CYCLOPENTA[A]ANTHRACENE- 2,6,11-TRIONE | A | 1N5V | 0.71 | ![]() |
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 | ![]() |
26C![]() | A,B | 2F7I | 0.71 | ![]() | |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A | 1THL | 0.72 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | A,B | 2AY7 | 0.72 | ![]() |
CLT![]() | 4-PHENYL-BUTANOIC ACID | E,I | 1TMN | 0.72 | ![]() |
4MA![]() | 4-METHYLBENZOIC ACID | A,H | 2HRG | 0.71 | ![]() |
FL2![]() | FLURBIPROFEN METHYL ESTER | A,B | 1HT5 | 0.73 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B,C,D | 1HAB | 0.71 | ![]() |
CIN![]() | 4-CARBOXYCINNAMIC ACID | A,B | 1T6J | 0.71 | ![]() |
BZM![]() | BENZOIC ACID PHENYLMETHYLESTER | A,B | 1DZM | 0.78 | ![]() |
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 | ![]() |
4FC![]() | A | 1YSG | 0.72 | ![]() | |
PPT![]() | 3-(P-TOLYL)PROPIONIC ACID | A,B | 2AY4 | 0.71 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A | 1CBX | 0.73 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A | 1HYT | 0.73 | ![]() |
BZS![]() | L-BENZYLSUCCINIC ACID | A,B | 1WHT | 0.73 | ![]() |
DFA![]() | DIPHENYLACETIC ACID | A,B,C | 1GMY | 0.73 | ![]() |
ELI![]() | 6-(3-METHYL-1,4-DIOXO-1,4-DIHYDRONAPHTHALEN- 2-YL)HEXANOIC ACID | A,B | 2GH5 | 0.74 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A | 1U4O | 0.72 | ![]() |
NDD![]() | 2,6-DICARBOXYNAPHTHALENE | A,B,C,D | 1HAC | 0.72 | ![]() |
BFL![]() | A,B | 1Q4G | 0.72 | ![]() | |
TRZ![]() | TRAZEOLIDE | A | 1C12 | 0.7 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1BXG | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1TOG | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1V2F | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1AHX | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A | 1TOI | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A,B | 1AY8 | 0.71 | ![]() |
HCI![]() | HYDROCINNAMIC ACID | A | 1TOJ | 0.71 | ![]() |
IBP![]() | IBUPROFEN | A | 3FKX | 0.71 | ![]() |
IBP![]() | IBUPROFEN | A,B | 2BXG | 0.71 | ![]() |
IBP![]() | IBUPROFEN | A,B | 1EQG | 0.71 | ![]() |
IBP![]() | IBUPROFEN | A,B,C | 2WD9 | 0.71 | ![]() |
IBP![]() | IBUPROFEN | A | 2PWS | 0.71 | ![]() |
CP5![]() | (2Z)-3-{[OXIDO(OXO)PHOSPHINO]OXY}- 2-PHENYLACRYLATE | A | 1SCW | 0.71 | ![]() |
BIP![]() | 2-BENZYL-3-IODOPROPANOIC ACID | A,B,C,D | 1BAV | 0.71 | ![]() |
NIU![]() | 6,7,8,9-TETRAHYDRO-4-HYDROXY-3- (1-PHENYLPROPYL)CYCLOHEPTA[B]PYRAN- 2-ONE | A | 6UPJ | 0.75 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A | 1FHV | 0.74 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B,C,D | 1SJB | 0.74 | ![]() |
OSB![]() | 2-SUCCINYLBENZOATE | A,B | 2QVH | 0.74 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | A,B,C,D | 1LRH | 0.72 | ![]() |
NLA![]() | NAPHTHALEN-1-YL-ACETIC ACID | B | 2P1O | 0.72 | ![]() |