Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02981989
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 |
17A![]() | (2S)-2-[3-(AMINOMETHYL)PHENYL]- 3-[(R)-{(1R)-1-[(BIPHENYL-4-YLSULFONYL)AMINO]- 2-METHYLPROPYL}(HYDROXY)PHOSPHORYL]PROPANOIC ACID | A,B,C | 2PJ8 | 0.7 | ![]() |
M28![]() | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A,B | 2NN1 | 0.72 | ![]() |
M28![]() | 3-[4-(AMINOSULFONYL)PHENYL]PROPANOIC ACID | A | 2NNO | 0.72 | ![]() |
SUB![]() | 3-PHENYL-2-{[4-(TOLUENE-4-SULFONYL)- THIOMORPHOLINE-3-CARBONYL]-AMINO}- PROPIONIC ACID ETHYL ESTER | A | 1J4H | 0.7 | ![]() |
AL5![]() | THIOPHENE-2,5-DISULFONIC ACID 2- AMIDE-5-(4-METHYL-BENZYLAMIDE) | A | 1BN1 | 0.76 | ![]() |
53N![]() | 3-[5-(3-nitrophenyl)thiophen-2- yl]propanoic acid | A | 3DN5 | 0.72 | ![]() |
MZ2![]() | (2E)-N-[(1S,2R)-1-BENZYL-2-HYDROXY- 3-{(2-THIENYLMETHYL)[(2,4,5-TRIFLUOROPHENYL)SULFONYL]AMINO}PROPYL]- 4,4,4-TRIFLUORO-3-METHYLBUT-2-ENAMIDE | A,B | 2QHZ | 0.72 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1O0D | 0.75 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FES | 0.75 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2ANK | 0.75 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 2FEQ | 0.75 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | H,P | 2A2X | 0.75 | ![]() |
SMF![]() | 4-SULFOMETHYL-L-PHENYLALANINE | D,H | 1NZQ | 0.75 | ![]() |
160![]() | 3-(3-{2-[(5-METHANESULFONYL-THIOPHENE- 2-CARBONYL)-AMINO]-ETHYLDISULFANYLMETHYL}- BENZENESULFONYLAMINO)-4-OXO-PENTANOIC ACID | A,B | 1NMQ | 0.78 | ![]() |
PTS![]() | (4S-TRANS)-4-(AMINO)-5,6-DIHYDRO- 6-METHYL-4H-THIENO (2,3-B)THIOPYRAN- 2-SULFONAMIDE-7,7-DIOXIDE | A | 1CIM | 0.71 | ![]() |
CXA![]() | PHENYLALANINE-N-SULFONAMIDE | A | 1IY7 | 0.72 | ![]() |
TST![]() | 4-METHYL-2-{[4-(TOLUENE-4-SULFONYL)- THIOMORPHOLINE-3-CARBONYL]-AMINO}- PENTANOIC ACID | A | 1J4I | 0.71 | ![]() |
FIH![]() | 5-(4-FLUOROPHENYL)-3-{[(4-METHYLPHENYL)SULFONYL]AMINO}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 2D3Z | 0.74 | ![]() |
MZ1![]() | N~2~-ACETYL-N-[(1S,2R)-1-BENZYL- 2-HYDROXY-3-{(2-THIENYLMETHYL)[(2,4,5- TRIFLUOROPHENYL)SULFONYL]AMINO}PROPYL]- L-ALANINAMIDE | A,B | 2QHY | 0.72 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1MMK | 0.78 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | B | 1EOJ | 0.78 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1KW0 | 0.78 | ![]() |
TIH![]() | BETA(2-THIENYL)ALANINE | A | 1BDK | 0.78 | ![]() |
SM3![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1PI4 | 0.73 | ![]() |
SM3![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 2FFY | 0.73 | ![]() |
SM3![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- PHENYLMETHYLBORONIC ACID | A,B | 1MY8 | 0.73 | ![]() |
SM4![]() | (1R)-1-(2-THIOPHEN-2-YL-ACETYLAMINO)- 1-(3-(2-CARBOXYVINYL)-PHENYL) METHYLBORONIC ACID | A,B | 2RCX | 0.72 | ![]() |
CCT![]() | 5-(4-CYANOPHENYL)-3-{[(2-METHYLPHENYL)SULFONYL]AMINO}THIOPHENE- 2-CARBOXYLIC ACID | A,B | 2D3U | 0.71 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1PI5 | 0.73 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A | 1NXY | 0.73 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1MXO | 0.73 | ![]() |
SM2![]() | (1R)-1-(2-THIENYLACETYLAMINO)-1- (3-CARBOXYPHENYL)METHYLBORONIC ACID | A,B | 1YM1 | 0.73 | ![]() |
DSV![]() | N-(dibenzo[b,d]thiophen-3-ylsulfonyl)- L-valine | A | 2K2G | 0.75 | ![]() |
TPR![]() | TOSYL-D-PROLINE | A | 1F4E | 0.71 | ![]() |
235![]() | (2S)-2-[3-(AMINOMETHYL)PHENYL]- 3-[(R)-HYDROXY{(1R)-2-METHYL-1- [(PHENYLSULFONYL)AMINO]PROPYL}PHOSPHORYL]PROPANOIC ACID | A,B,C | 2PJ7 | 0.71 | ![]() |
BDL![]() | N-(biphenyl-4-ylsulfonyl)-D-leucine | A | 3EHX | 0.73 | ![]() |
2BL![]() | (3R)-3-ethyl-N-[(4-methylphenyl)sulfonyl]- L-aspartic acid | A | 1BTU | 0.75 | ![]() |
SNH![]() | A,B | 2D41 | 0.72 | ![]() | |
TPX![]() | (2S,3S)-3-FORMYL-2-({[(4-METHYLPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | A | 1QGF | 0.73 | ![]() |
TPX![]() | (2S,3S)-3-FORMYL-2-({[(4-METHYLPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | B | 1E34 | 0.73 | ![]() |
TPX![]() | (2S,3S)-3-FORMYL-2-({[(4-METHYLPHENYL)SULFONYL]AMINO}METHYL)PENTANOIC ACID | B | 1E35 | 0.73 | ![]() |
C9P![]() | 4-(dihydroxyboranyl)-2-({[4-(phenylsulfonyl)thiophen- 2-yl]sulfonyl}amino)benzoic acid | A,B | 3BM6 | 0.76 | ![]() |