Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00068001
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 |
ZY0![]() | N-[(1S,2R)-1-BENZYL-2-HYDROXY-3- {[3-(TRIFLUOROMETHYL)BENZYL]AMINO}PROPYL]- 4-ETHYL-8-(2-OXO-2,3-DIHYDRO-1H- PYRROL-1-YL)QUINOLINE-6-CARBOXAMIDE | A | 2WF0 | 0.71 | ![]() |
IAG![]() | N-[1H-INDOL-3-YL-ACETYL]GLYCINE ACID | A,B | 1K8Z | 0.7 | ![]() |
IAG![]() | N-[1H-INDOL-3-YL-ACETYL]GLYCINE ACID | A,B | 1K7E | 0.7 | ![]() |
P4O![]() | 2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)- 1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2- C]PYRIDIN-4-ONE | A | 2JBO | 0.72 | ![]() |
P4O![]() | 2-(2-QUINOLIN-3-YLPYRIDIN-4-YL)- 1,5,6,7-TETRAHYDRO-4H-PYRROLO[3,2- C]PYRIDIN-4-ONE | A,B,C,D,E,F, G,H,I,K,L | 2JBP | 0.72 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A | 1LIH | 0.73 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A | 2LIG | 0.73 | ![]() |
PHN![]() | 1,10-PHENANTHROLINE | A,B | 2FU7 | 0.73 | ![]() |
VX3![]() | 2,3-diphenyl-1H-indole-7-carboxylic acid | A | 3BGZ | 0.74 | ![]() |
SU1![]() | 3-[(3-(2-CARBOXYETHYL)-4-METHYLPYRROL- 2-YL)METHYLENE]-2-INDOLINONE | A,B | 1FGI | 0.72 | ![]() |
RSS![]() | 5-METHYL-3-(9-OXO-1,8-DIAZA-TRICYCLO[10.6.1.013,18]NONADECA- 12(19),13,15,17-TETRAEN-10-YLCARBAMOYL)- HEXANOIC ACID | A,B | 1MMP | 0.7 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C | 1KQG | 0.71 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,D,E,F | 2VR0 | 0.71 | ![]() |
HQO![]() | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,M,N,O,P | 1KF6 | 0.71 | ![]() |
2S8![]() | (2S)-8-[(tert-butoxycarbonyl)amino]- 2-(1H-indol-3-yl)octanoic acid | B | 3C6N | 0.71 | ![]() |
BRF![]() | A | 1UUO | 0.85 | ![]() | |
COP![]() | N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID | A | 1OHJ | 0.71 | ![]() |
COP![]() | N-(4-CARBOXY-4-{4-[(2,4-DIAMINO- PTERIDIN-6-YLMETHYL)-AMINO]-BENZOYLAMINO}- BUTYL)-PHTHALAMIC ACID | A | 1OHK | 0.71 | ![]() |
DK1![]() | 5,7-DICHLORO-4-HYDROXYQUINOLINE- 2-CARBOXYLIC ACID | A,B | 1PBQ | 0.72 | ![]() |
POO![]() | 3-CYCLOHEXYL-1-(2-{METHYL[(1-METHYLPIPERIDIN- 3-YL)METHYL]AMINO}-2-OXOETHYL)- 2-PHENYL-1H-INDOLE-6-CARBOXYLIC ACID | A | 2BRL | 0.78 | ![]() |
4HG![]() | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G19 | 0.74 | ![]() |
4HG![]() | N-[(4-HYDROXY-8-IODOISOQUINOLIN- 3-YL)CARBONYL]GLYCINE | A | 2G1M | 0.74 | ![]() |
4PP![]() | C,L | 1XKA | 0.76 | ![]() | |
4PP![]() | A,B,C,D | 1XKB | 0.76 | ![]() | |
OAI![]() | 6-(OXALYL-AMINO)-1H-INDOLE-5-CARBOXYLIC ACID | A | 1C83 | 0.72 | ![]() |
MMG![]() | 4-(5-phenyl-1H-pyrrolo[2,3-b]pyridin- 3-yl)benzoic acid | A | 3HDM | 0.72 | ![]() |
4HT![]() | 4-HYDROXYTRYPTOPHAN | H,L | 1RU9 | 0.73 | ![]() |
4HT![]() | 4-HYDROXYTRYPTOPHAN | H,L | 1RUM | 0.73 | ![]() |
4HT![]() | 4-HYDROXYTRYPTOPHAN | H,L | 1RUL | 0.73 | ![]() |
4HT![]() | 4-HYDROXYTRYPTOPHAN | H,L | 1RUA | 0.73 | ![]() |
C80![]() | (2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)- 5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1- BENZYL-1H-INDOLE-3-CARBOXYLATE | C,O | 2V11 | 0.71 | ![]() |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | C,D,E | 1NU1 | 0.71 | ![]() |
QNO![]() | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | A,B,C,D,G | 2E75 | 0.71 | ![]() |
TRX![]() | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 1K83 | 0.72 | ![]() |
TRX![]() | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L, M,T | 2VUM | 0.72 | ![]() |
TRX![]() | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 3CQZ | 0.72 | ![]() |
PAA![]() | (N-METHYLPYRIDYL)ACETIC ACID | I | 1HBT | 0.71 | ![]() |
3IB![]() | 3-INDOLEBUTYRIC ACID | A,B | 2AY6 | 0.76 | ![]() |
3IB![]() | 3-INDOLEBUTYRIC ACID | A,B,C,E | 2GJ6 | 0.76 | ![]() |
826![]() | 1,3,4,9-TETRAHYDRO-2-(HYDROXYBENZOYL)- 9-[(4-HYDROXYPHENYL)METHYL]-6-METHOXY- 2H-PYRIDO[3,4-B]INDOLE | A,B | 1I30 | 0.72 | ![]() |
PYA![]() | 3-(1,10-PHENANTHROL-2-YL)-L-ALANINE | A | 1HCW | 0.82 | ![]() |
CNQ![]() | 3-(4-CHLOROPHENYL)QUINOXALINE-5- CARBOXAMIDE | A,B,C,D | 1WOK | 0.72 | ![]() |
PBG![]() | 3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)- 1H-PYRROL-3-YL]PROPANOIC ACID | A,B | 1E51 | 0.71 | ![]() |
PBG![]() | 3-[5-(AMINOMETHYL)-4-(CARBOXYMETHYL)- 1H-PYRROL-3-YL]PROPANOIC ACID | A | 1OHL | 0.71 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH4 | 0.72 | ![]() |
R69![]() | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH9 | 0.72 | ![]() |
SN6![]() | 1-METHYL-4-[4-[4-(4-(1-METHYLQUINOLINIUM)AMINO)BENZAMIDO]ANILINO]PYRIDINIUM | A,B | 144D | 0.73 | ![]() |
2S3![]() | (2S)-2-(1H-indol-3-yl)pentanoic acid | B | 3C6P | 0.75 | ![]() |
ITR![]() | IMINO-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.75 | ![]() |
238![]() | A | 2PRH | 0.8 | ![]() | |
D3E![]() | N-cyclopropyl-N-(trans-4-pyridin- 3-ylcyclohexyl)-4-[(1S)-2,2,2-trifluoro- 1-hydroxy-1-methylethyl]benzamide | A,B,C,D | 3D3E | 0.79 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYN | 0.87 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYK | 0.87 | ![]() |
NPV![]() | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A | 2QYL | 0.87 | ![]() |
NTM![]() | QUINOLINIC ACID | A | 3C2O | 0.76 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B | 1QAP | 0.76 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C,D,E,F | 1QPQ | 0.76 | ![]() |
NTM![]() | QUINOLINIC ACID | A,B,C | 2B7N | 0.76 | ![]() |
SN7![]() | 4-[4-[2-AMINO-4-[4,6-(N-METHYLQUINOLINIUM)AMINO]BENZAMIDO]ANILINO]- N-METHYLPYRIDINIUM MESYLATE | A | 328D | 0.71 | ![]() |
CMF![]() | 3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL- 2-OXOETHYL)-2-PHENYL-1H-INDOLE- 6-CARBOXYLIC ACID | A | 2BRK | 0.76 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLN | 0.78 | ![]() |
6PC![]() | PYRIDINE-2-CARBOXYLIC ACID | A | 2OLO | 0.78 | ![]() |
PAT![]() | ALPHA-PHOSPHONO-TRYPTOPHAN | A,B | 1I73 | 0.72 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCK | 0.7 | ![]() |
NNO![]() | 6-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCM | 0.7 | ![]() |
3HM![]() | 5-hydroxy-6-methylpyridine-3-carboxylic acid | A,B | 3GMC | 0.71 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,D | 2R3C | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY8 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5D | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2V7K | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,D | 1CZQ | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DFY | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY5 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1NXN | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1TKF | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1YL9 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XXZ | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY4 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,D | 2Q3I | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1QFB | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DFZ | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY9 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1XY6 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2SOC | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 2JUE | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1SOC | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1YL8 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,D,E,F, G,H | 1DDO | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B | 2Q33 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A | 1DG0 | 0.74 | ![]() |
DTR![]() | D-TRYPTOPHAN | A,B,C,H,K,L | 2R5B | 0.74 | ![]() |
DPT![]() | 4,7-DIMETHYL-[1,10]PHENANTHROLINE | A,B | 1I53 | 0.73 | ![]() |
HI6![]() | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHQ | 0.72 | ![]() |
HI6![]() | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2WHP | 0.72 | ![]() |
HI6![]() | 4-(AMINOCARBONYL)-1-[({2-[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]PYRIDINIUM | A,B | 2GYU | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1MTB | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGV | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | I | 1IVQ | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 2FGU | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A | 1JLD | 0.72 | ![]() |
QNC![]() | 2-CARBONYLQUINOLINE | A,B | 1HXB | 0.72 | ![]() |
4FW![]() | 4-FLUOROTRYPTOPHANE | A | 1RM9 | 0.73 | ![]() |
I4A![]() | 5-(3-carbamoylbenzyl)-5,6,7,8,9,10- hexahydrocyclohepta[b]indole-4- carboxylic acid | A | 3FR5 | 0.77 | ![]() |
HQU![]() | 3-HYDROXYQUINALDIC ACID | C,D | 193D | 0.77 | ![]() |
1IQ![]() | 2-(4-ISOPROPYL-4-METHYL-5-OXO-4,5- DIHYDRO-1H-IMIDAZOL-2-YL)QUINOLINE- 3-CARBOXYLIC ACID | A | 1Z8N | 0.76 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A | 2JT8 | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A,B | 1NF0 | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A | 2JTZ | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A,B | 1I45 | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A,B | 2ZNX | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A,B | 1NEY | 0.73 | ![]() |
FTR![]() | FLUOROTRYPTOPHANE | A,B | 5FWG | 0.73 | ![]() |
PXG![]() | 3-[O-PHOSPHONOPYRIDOXYL]--AMINO- BENZOIC ACID | A | 1B9I | 0.75 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2I0T | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | A,B,C,D,K,L, M,N | 2J57 | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2OK4 | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2IUR | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2AGW | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | A,B,H,L,M | 2J56 | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2IUV | 0.7 | ![]() |
TQQ![]() | (S)-2-AMINO-3-(6,7-DIHYDRO-6-IMINO- 7-OXO-1H-INDOL-3-YL)PROPANOIC ACID | D,H | 2OK6 | 0.7 | ![]() |
3IO![]() | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | A,B,C,D | 1XES | 0.74 | ![]() |
3IO![]() | 3-(1H-INDOL-3-YL)-2-OXOPROPANOIC ACID | B,C,D | 1XET | 0.74 | ![]() |
PMC![]() | 3-(PHOSPHONOMETHYL)PYRIDINE-2-CARBOXYLIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I43 | 0.78 | ![]() |
R55![]() | N-[4-({4-[5-(4,4-DIMETHYLPIPERIDIN- 1-YL)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH8 | 0.71 | ![]() |
MPE![]() | (1H-INDOL-3-YL)-(2-MERCAPTO-ETHOXYIMINO)- ACETIC ACID | A | 1M4A | 0.71 | ![]() |
9AC![]() | 9-ACRIDINECARBONYL | A,B,G,J,K,L,M | 1G3X | 0.75 | ![]() |
BRE![]() | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID | A | 1D3G | 0.85 | ![]() |
R96![]() | N-[4-({4-[5-(3,3-DIMETHYLPIPERIDIN- 1-YL)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH7 | 0.71 | ![]() |
FIC![]() | 5-fluoroindole-2-carboxylic acid | A,B | 3DWS | 0.71 | ![]() |
HRP![]() | 5-HYDROXY-L-TRYPTOPHAN | B | 1YIA | 0.74 | ![]() |
8CA![]() | 9-benzyl-2,3,4,9-tetrahydro-1H- carbazole-8-carboxylic acid | A | 3FR2 | 0.78 | ![]() |
IMQ![]() | (2R,3R,4S)-2-(hydroxymethyl)-1- (quinolin-8-ylmethyl)pyrrolidine- 3,4-diol | A,B | 3EPX | 0.7 | ![]() |
QUA![]() | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | C | 2JQ7 | 0.76 | ![]() |
QUA![]() | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | B | 1OLN | 0.76 | ![]() |
QUA![]() | 8-HYDROXY-4-(1-HYDROXYETHYL)QUINOLINE- 2-CARBOXYLIC ACID | A | 1E9W | 0.76 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1PFE | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 2DA8 | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C,E,G | 2ADW | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1VS2 | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVN | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 185D | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A | 1XVK | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,C | 1XVR | 0.72 | ![]() |
QUI![]() | 2-CARBOXYQUINOXALINE | A,B | 3GO3 | 0.72 | ![]() |
5IQ![]() | ISOQUINOLIN-5-AMINE | A,B | 2F2T | 0.7 | ![]() |
BMS![]() | A,B | 1DKF | 0.82 | ![]() | |
ET0![]() | 3-(5-methoxy-1H-indol-3-yl)propanoic acid | A,B | 3ET0 | 0.71 | ![]() |
FT6![]() | 6-FLUORO-L-TRYPTOPHAN | A,B | 2NW9 | 0.73 | ![]() |
NFL![]() | 2-{[3-(TRIFLUOROMETHYL)PHENYL]AMINO}NICOTINIC ACID | A | 1TD7 | 0.74 | ![]() |
A2T![]() | N-[1-(3-METHYLBUTYL)PIPERIDIN-4- YL]-N-{4-[METHYL(PYRIDIN-4-YL)AMINO]BENZYL}- 4-PENTYLBENZAMIDE | A,B | 2IGY | 0.71 | ![]() |
DGB![]() | N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]- 3-PYRIDIN-3-YLPROPANAMIDE | A,B | 2G97 | 0.72 | ![]() |
DGB![]() | N-[4-(1-BENZOYLPIPERIDIN-4-YL)BUTYL]- 3-PYRIDIN-3-YLPROPANAMIDE | A,B | 2GVJ | 0.72 | ![]() |
BP5![]() | 3-(2,2'-BIPYRIDIN-5-YL)-L-ALANINE | A | 2PXH | 0.77 | ![]() |
HLO![]() | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEY | 0.72 | ![]() |
HLO![]() | 1-[({2,4-BIS[(E)-(HYDROXYIMINO)METHYL]PYRIDINIUM- 1-YL}METHOXY)METHYL]-4-CARBAMOYLPYRIDINIUM | A,B | 2JEZ | 0.72 | ![]() |
MYT![]() | METYRAPONE | A | 1PHG | 0.73 | ![]() |
MYT![]() | METYRAPONE | A | 1W0G | 0.73 | ![]() |
TRO![]() | 2-HYDROXY-TRYPTOPHAN | A | 1KB0 | 0.7 | ![]() |
TRO![]() | 2-HYDROXY-TRYPTOPHAN | A | 1G3P | 0.7 | ![]() |
QND![]() | QUINALDIC ACID | A,B | 1IDA | 0.85 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PC2 | 0.73 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B,C,D | 1ARZ | 0.73 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PE7 | 0.73 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A | 2PES | 0.73 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B | 1C3V | 0.73 | ![]() |
PDC![]() | PYRIDINE-2,6-DICARBOXYLIC ACID | A,B | 1P9L | 0.73 | ![]() |
3IL![]() | 3-(INDOL-3-YL) LACTATE | A | 2A7P | 0.72 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A,B | 1AHF | 0.75 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A | 2OLI | 0.75 | ![]() |
IOP![]() | INDOLYLPROPIONIC ACID | A,B | 2AY5 | 0.75 | ![]() |
2S2![]() | (2S)-2-(1H-indol-3-yl)hexanoic acid | B | 3C6O | 0.75 | ![]() |
PRR![]() | 3-(METHYL-PYRIDINIUM)ALANINE | H,I,J | 7KME | 0.72 | ![]() |
HQA![]() | 3-(8-hydroxyquinolin-3-yl)-L-alanine | A,B | 3FCA | 0.78 | ![]() |
HTR![]() | BETA-HYDROXYTRYPTOPHANE | A,B | 1QPA | 0.75 | ![]() |
HTR![]() | BETA-HYDROXYTRYPTOPHANE | A,B | 1B80 | 0.75 | ![]() |
HTR![]() | BETA-HYDROXYTRYPTOPHANE | A | 1ROV | 0.75 | ![]() |
ICO![]() | 1H-INDOLE-3-CARBOXYLIC ACID | L | 2PIP | 0.81 | ![]() |
0AF![]() | 7-hydroxy-L-tryptophan | L | 1MAE | 0.7 | ![]() |
0AF![]() | 7-hydroxy-L-tryptophan | L | 1MAF | 0.7 | ![]() |
R94![]() | N-(4-{[4-(2-HYDROXY-5-PIPERIDIN- 1-YLBENZOYL)BENZOYL]AMINO}AZEPAN- 3-YL)ISONICOTINAMIDE | A | 1XH6 | 0.72 | ![]() |
9HP![]() | 9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE | A | 1PMU | 0.79 | ![]() |
IAC![]() | 1H-INDOL-3-YLACETIC ACID | B | 2P1Q | 0.76 | ![]() |
IAC![]() | 1H-INDOL-3-YLACETIC ACID | A | 2OYF | 0.76 | ![]() |
IAC![]() | 1H-INDOL-3-YLACETIC ACID | A,B | 3FVU | 0.76 | ![]() |
IAC![]() | 1H-INDOL-3-YLACETIC ACID | B | 2P1P | 0.76 | ![]() |
24X![]() | H,L | 2EC9 | 0.73 | ![]() | |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 2NMW | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 3D1Y | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 2NMY | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 3CYX | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 2NNP | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | B | 1C6Z | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 2NNK | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A | 1FB7 | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 2NMZ | 0.7 | ![]() |
ROC![]() | N~1~-{(1S,2R)-1-benzyl-3-[(3R,4aR,8aR)- 3-(tert-butylcarbamoyl)octahydroisoquinolin- 2(1H)-yl]-2-hydroxypropyl}-N~2~- (quinolin-2-ylcarbonyl)-L-aspartamide | A,B | 3D1X | 0.7 | ![]() |
INO![]() | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCL | 0.73 | ![]() |
INO![]() | 2-HYDROXYISONICOTINIC ACID N-OXIDE | M,N,O,P,Q,R | 3PCJ | 0.73 | ![]() |
F8A![]() | 9-[2-(trifluoromethyl)benzyl]-2,3,4,9- tetrahydro-1H-carbazole-8-carboxylic acid | A | 3FR4 | 0.76 | ![]() |
PT1![]() | PTEROIC ACID | A,B | 1TX0 | 0.71 | ![]() |
PT1![]() | PTEROIC ACID | A | 1BR6 | 0.71 | ![]() |
PT1![]() | PTEROIC ACID | A,B | 1HWP | 0.71 | ![]() |
4IN![]() | 4-AMINO-L-TRYPTOPHAN | A,B | 2HXX | 0.72 | ![]() |
4IN![]() | 4-AMINO-L-TRYPTOPHAN | A | 1OXF | 0.72 | ![]() |
CRZ![]() | 4-(9H-CARBAZOL-9-YL)BUTANOIC ACID | A | 1TOW | 0.71 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHQ | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5L | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2F7F | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5K | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHY | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1FSL | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L5M | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHO | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 3CI8 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICU | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D,E,F, G,H | 3HRD | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHA | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1L4N | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 2LH6 | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1D0V | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B,C,D | 1ICV | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A,B | 1ICR | 0.76 | ![]() |
NIO![]() | NICOTINIC ACID | A | 1JHR | 0.76 | ![]() |
PF7![]() | 4-(quinolin-3-ylmethyl)piperidine- 1-carboxylic acid | A,B | 2VYA | 0.78 | ![]() |
T19![]() | PHENYLMETHYLENECARBOXY-(METHYLENEAMINO- FORMYL-DIPHENYLMETHYL)METHY-PRO- BOROVAL | H,I | 1AIX | 0.7 | ![]() |
A1T![]() | 5-PENTYL-N-{[4'-(PIPERIDIN-1-YLCARBONYL)BIPHENYL- 4-YL]METHYL}-N-[1-(PYRIDIN-2-YLMETHYL)PIPERIDIN- 4-YL]PYRIDINE-2-CARBOXAMIDE | A | 2IGX | 0.71 | ![]() |
CRR![]() | 3,4-DI-1H-INDOL-3-YL-1H-PYRROLE- 2,5-DICARBOXYLIC ACID | A | 2Z3U | 0.74 | ![]() |
KAW![]() | N-{(5S)-4,4-dihydroxy-6-phenyl- 5-[(phenylcarbonyl)amino]hexanoyl}- L-tryptophan | A | 3BKL | 0.73 | ![]() |
LG2![]() | 6-[1-(3,5,5,8,8-PENTAMETHYL-5,6,7,8- TETRAHYDRONAPHTHALEN-2-YL)CYCLOPROPYL]PYRIDINE- 3-CARBOXYLIC ACID | A,B,C,D | 1H9U | 0.82 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,B | 1CQ1 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,B | 1OTW | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,B | 1C9U | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 1W6S | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,B | 1FLG | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A | 1KV9 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 2AD6 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,B | 1CRU | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 1H4I | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 2AD7 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 2AD8 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,D,I | 2D0V | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 4AAH | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C,E,G | 1H4J | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A | 1KB0 | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A | 1YIQ | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 1LRW | 0.71 | ![]() |
PQQ![]() | PYRROLOQUINOLINE QUINONE | A,C | 1G72 | 0.71 | ![]() |
FXV![]() | METHYL-3-(4'-N-OXOPYRIDYLPHENOYL)- 3-METHYL-2-(M-AMIDINOBENZYL)-PROPIONATE | A | 1KSN | 0.71 | ![]() |
NA4![]() | 4-[5-(2-CARBOXY-1-FORMYL-ETHYLCARBAMOYL)- PYRIDIN-3-YL]-BENZOIC ACID | A,C | 1RHM | 0.76 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B,C | 2W2I | 0.8 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A | 2GKL | 0.8 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2VD7 | 0.8 | ![]() |
PD2![]() | PYRIDINE-2,4-DICARBOXYLIC ACID | A,B | 2JIG | 0.8 | ![]() |
TRF![]() | N1-FORMYL-TRYPTOPHAN | A,B | 1VRK | 0.73 | ![]() |
TRF![]() | N1-FORMYL-TRYPTOPHAN | A,B,C,D | 1QS7 | 0.73 | ![]() |