Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs02403874
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 |
124 | 2-(2-HYDROXY-PHENYL)-1H-INDOLE- 5-CARBOXAMIDINE | A | 1GI6 | 0.73 | |
P3D | (4-{(E)-[(5-AMINOPENTYL)IMINO]METHYL}- 5-HYDROXY-6-METHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2PLK | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 3GZC | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2GJ4 | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2GM9 | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2IEG | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2IEI | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 3FZ8 | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 1PMO | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D,E,F | 3FSL | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2CFB | 0.72 | |
PLR | (5-HYDROXY-4,6-DIMETHYLPYRIDIN- 3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B,C,D | 3GZD | 0.72 | |
RO0 | 1-(3,4-DIMETHOXYBENZYL)-6,7-DIMETHOXY- 4-{[4-(2-METHOXYPHENYL)PIPERIDIN- 1-YL]METHYL}ISOQUINOLINE | A | 2FVJ | 0.77 | |
3ID | 3H-INDOLE-5,6-DIOL | A | 1F9B | 0.76 | |
3ID | 3H-INDOLE-5,6-DIOL | A | 1OYO | 0.76 | |
BMS | A,B | 1DKF | 0.74 | ||
SRO | SEROTONIN | A,B | 3BRN | 0.79 | |
SRO | SEROTONIN | A | 2QEH | 0.79 | |
PIX | 4-(3-{[5-(trifluoromethyl)pyridin- 2-yl]oxy}benzyl)piperidine-1-carboxylic acid | A,B | 2WAP | 0.72 | |
DIT | DITERCALINIUM | A | 1D32 | 0.7 | |
ASE | N-ACETYL SEROTONIN | A | 1NAS | 0.76 | |
ELP | (1R)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]-1-PHENYLETHYLPHOSPHONIC ACID | A | 1M0P | 0.77 | |
7NH | [2'-HYDROXY-3'-(1H-PYRROLO[3,2- C]PYRIDIN-2-YL)-BIPHENYL-3-YLMETHYL]- UREA | H | 2FLR | 0.77 | |
MPM | (1R)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]-1-METHYLPROPYLPHOSPHONIC ACID | A | 1M0O | 0.72 | |
NPL | N-METHYL-4-DEOXY-4-AMINO-PYRIDOXAL- 5-PHOSPHATE | A | 1SPA | 0.72 | |
NPL | N-METHYL-4-DEOXY-4-AMINO-PYRIDOXAL- 5-PHOSPHATE | A | 1ASC | 0.72 | |
PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D | 1HO4 | 0.71 | |
PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D,E,F, G,H | 3F4N | 0.71 | |
PXP | PYRIDOXINE-5'-PHOSPHATE | A,B,C,D | 1SZR | 0.71 | |
9HP | 9-(4-HYDROXYPHENYL)-2,7-PHENANTHROLINE | A | 1PMU | 0.89 | |
PXG | 3-[O-PHOSPHONOPYRIDOXYL]--AMINO- BENZOIC ACID | A | 1B9I | 0.7 | |
QUN | QUINACRINE | A,B | 1JQE | 0.72 | |
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 | 0.73 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1MDO | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 2YRI | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D,E,F | 2EJ0 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D,E,F | 3FZ6 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 2R2N | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1ZC9 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 2ZC0 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1AMR | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2QB3 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1KTA | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 1SZU | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 1UU1 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2Q7W | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 2GSA | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1YIY | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 3E2Y | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 2HOZ | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1FG7 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 3GSB | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2QA3 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D,E,F | 3BWN | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 1SZK | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 2F8J | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2AAT | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2CJG | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2QBT | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1AMS | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2E7U | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1A0G | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2C81 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C | 2ZSM | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1AIB | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 3E2Z | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 1BKG | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 2FNU | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1AMQ | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1AIC | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2EPJ | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2QB2 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C,D | 1SZS | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 1W7N | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 2ZSL | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A | 3BS8 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1UU2 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1XQL | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B,C | 3CQ5 | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 9AAT | 0.71 | |
PMP | 4'-DEOXY-4'-AMINOPYRIDOXAL-5'-PHOSPHATE | A,B | 1AIA | 0.71 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 1K83 | 0.75 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L, M,T | 2VUM | 0.75 | |
TRX | 6-HYDROXYTRYPTOPHAN | A,B,C,I,J,L,M | 3CQZ | 0.75 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QX4 | 0.71 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QX6 | 0.71 | |
ML1 | N-[2-(5-methoxy-1H-indol-3-yl)ethyl]acetamide | A,B | 2QWX | 0.71 | |
CQA | 4-[(7-CHLOROQUINOLIN-4-YL)AMINO]- 2-[(DIETHYLAMINO)METHYL]PHENOL | A,B | 2AOU | 0.84 | |
P13 | N-[2-(3-AMINOPROPOXY)-5-(1H-INDOL- 5-YL)BENZYL]-N-(2-PIPERAZIN-1-YLETHYL)AMINE | B | 1UTS | 0.74 | |
AEJ | (1S)-1-{4-[(9AR)-OCTAHYDRO-2H-PYRIDO[1,2- A]PYRAZIN-2-YL]PHENYL}-2-PHENYL- 1,2,3,4-TETRAHYDROISOQUINOLIN-6- OL | A,B,C,D | 1XQC | 0.72 | |
826 | 1,3,4,9-TETRAHYDRO-2-(HYDROXYBENZOYL)- 9-[(4-HYDROXYPHENYL)METHYL]-6-METHOXY- 2H-PYRIDO[3,4-B]INDOLE | A,B | 1I30 | 0.73 | |
ALH | 6-PHENYL[5H]PYRROLO[2,3-B]PYRAZINE | A,B | 1UNG | 0.73 | |
253 | 10,11-dimethoxy-4-methyldibenzo[c,f]- 2,7-naphthyridine-3,6-diamine | A | 2R7B | 0.75 | |
L5G | 7-methoxy-4-[(6-phenyl[1,2,4]triazolo[4,3- b]pyridazin-3-yl)methoxy]quinoline | A | 3CD8 | 0.71 | |
BRE | 2-BIPHENYL-4-YL-6-FLUORO-3-METHYL- QUINOLINE-4-CARBOXYLIC ACID | A | 1D3G | 0.71 | |
PHN | 1,10-PHENANTHROLINE | A | 1LIH | 0.7 | |
PHN | 1,10-PHENANTHROLINE | A | 2LIG | 0.7 | |
PHN | 1,10-PHENANTHROLINE | A,B | 2FU7 | 0.7 | |
PZZ | 3-{3-[(DIMETHYLAMINO)METHYL]-1H- INDOL-7-YL}PROPAN-1-OL | A | 2QHW | 0.7 | |
DEH | 2,9-dihydroxy-3,10-dimethoxy-5,6- dihydroisoquino[3,2-a]isoquinolinium | A | 3GSY | 0.82 | |
7PC | 2-[4-(AMINOMETHYL)-2-CHLOROPHENOXY]- 5-PYRIDIN-2-YLPHENOL | A,B | 2OP0 | 0.72 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AH0 | 0.71 | |
TSC | (1S)-1-AMINO-2-(1H-INDOL-3-YL)ETHANOL | D,H | 2AGZ | 0.71 | |
696 | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE | A | 1O3G | 0.72 | |
696 | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE | A | 1O3E | 0.72 | |
696 | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE | H,I | 1O2G | 0.72 | |
696 | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE | B | 1O5A | 0.72 | |
696 | 3-{5-[AMINO(IMINIO)METHYL]-1H-INDOL- 2-YL}-1,1'-BIPHENYL-2-OLATE | A | 1O3F | 0.72 | |
PYF | 3-PYRIDINYLCARBINOL | A,B | 1R16 | 0.7 | |
232 | 1,3-DI[[[10-METHOXY-7H-PYRIDO[4,3- C]CARBAZOL-2-IUMYL]-ETHYL]-PIPERIDIN- 4-YL]-PROPANE | A | 1C9Z | 0.7 | |
HEN | 2-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-IMINO]-5-PHOSPHONO- PENT-3-ENOIC ACID | A,B,C,D,E,F, G,H,I,J,K,L | 1I41 | 0.7 | |
859 | 2-({2-[(3-HYDROXYPHENYL)AMINO]PYRIMIDIN- 4-YL}AMINO)BENZAMIDE | A,B | 2NO3 | 0.71 | |
CEI | N-[3-BENZYL-5-(4-HYDROXYPHENYL)PYRAZIN- 2-YL]-2-(4-HYDROXYPHENYL)ACETAMIDE | A,B | 2PSJ | 0.72 | |
CEI | N-[3-BENZYL-5-(4-HYDROXYPHENYL)PYRAZIN- 2-YL]-2-(4-HYDROXYPHENYL)ACETAMIDE | A | 2F8P | 0.72 | |
CEI | N-[3-BENZYL-5-(4-HYDROXYPHENYL)PYRAZIN- 2-YL]-2-(4-HYDROXYPHENYL)ACETAMIDE | A | 1S36 | 0.72 | |
PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A | 1RFT | 0.74 | |
PXM | 4-(AMINOMETHYL)-5-(HYDROXYMETHYL)- 2-METHYLPYRIDIN-3-OL | A,B | 2Z9V | 0.74 | |
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 | 0.71 | |
IOS | 3-SULFOOXY-1H-INDOLE | A,B | 2BXH | 0.71 | |
2EA | (1S)-2-(1H-INDOL-3-YL)-1-{[(5-ISOQUINOLIN- 6-YLPYRIDIN-3-YL)OXY]METHYL}ETHYLAMINE | E | 2F7E | 0.71 | |
Q22 | (4aS)-5-[(2,4-diaminopteridin-6- yl)methyl]-4a,5-dihydro-2H-dibenzo[b,f]azepin- 8-ol | A | 3D80 | 0.71 | |
4EA | (1S)-2-(1H-INDOL-3-YL)-1-[({5-[(E)- 2-PYRIDIN-4-YLVINYL]PYRIDIN-3-YL}OXY)METHYL]ETHYLAMINE | E | 2F7X | 0.71 | |
CAU | (2S)-1-(9H-Carbazol-4-yloxy)-3- (isopropylamino)propan-2-ol | A | 2RH1 | 0.7 | |
T98 | 5-(4,4-DIMETHYL-2-THIOXO-1,4-DIHYDRO- 2H-3,1-BENZOXAZIN-6-YL)-1-METHYL- 1H-PYRROLE-2-CARBONITRILE | A,B | 1ZUC | 0.72 | |
BER | BERBERINE | A | 3D6Y | 0.77 | |
BER | BERBERINE | A,B,D,E | 1JUM | 0.77 | |
BER | BERBERINE | A,B,D,E | 3BTI | 0.77 | |
BER | BERBERINE | A | 2QVD | 0.77 | |
HFS | 1-(1-HYDROXY-5-ISOQUINOLINESULFONYL)HOMOPIPERAZINE | E | 2ERZ | 0.72 | |
HFS | 1-(1-HYDROXY-5-ISOQUINOLINESULFONYL)HOMOPIPERAZINE | A,B | 2ETK | 0.72 | |
P3T | (4-{[(4-AMINOBUTYL)AMINO]METHYL}- 5-HYDROXY-6-METHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE | A,B | 2PLJ | 0.71 | |
806 | 7-[[2-[[1-(1-IMINOETHYL)PIPERIDIN- 4-YL]OXY]-9H-CARBOZOL-9-YL]METHYL]NAPHTHALENE- 2-CARBOXIMIDAMID | A | 1QB9 | 0.71 | |
PF7 | 4-(quinolin-3-ylmethyl)piperidine- 1-carboxylic acid | A,B | 2VYA | 0.74 | |
HRP | 5-HYDROXY-L-TRYPTOPHAN | B | 1YIA | 0.73 | |
DPT | 4,7-DIMETHYL-[1,10]PHENANTHROLINE | A,B | 1I53 | 0.71 | |
FBQ | 1-[3-({[(4-AMINO-5-FLUORO-2-METHYLQUINOLIN- 3-YL)METHYL]THIO}METHYL)PHENYL]- 2,2,2-TRIFLUOROETHANE-1,1-DIOL | A | 1HBJ | 0.72 | |
HRM | 7-METHOXY-1-METHYL-9H-BETA-CARBOLINE | A | 2Z5X | 0.76 | |
HRM | 7-METHOXY-1-METHYL-9H-BETA-CARBOLINE | A | 2Z5Y | 0.76 | |
GK1 | 4-{4-[(5-hydroxy-2-methylphenyl)amino]quinolin- 7-yl}-1,3-thiazole-2-carbaldehyde | A | 2ZAZ | 0.76 | |
1BM | 3-{[2-(1H-BENZIMIDAZOL-1-YL)-6- {[2-(DIETHYLAMINO)ETHYL]AMINO}PYRIMIDIN- 4-YL]AMINO}-4-METHYLPHENOL | A | 2HK5 | 0.74 | |
W37 | N-(6-{[1-(4-BROMOPHENYL)ISOQUINOLIN- 6-YL]OXY}HEXYL)-N-METHYLPROP-2- EN-1-AMINE | A,B,C | 1O6H | 0.79 | |
DTQ | 4-[3-HYDROXYANILINO]-6,7-DIMETHOXYQUINAZOLINE | A | 1DI8 | 0.73 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYN | 0.7 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A,B | 2QYK | 0.7 | |
NPV | 4-[8-(3-nitrophenyl)-1,7-naphthyridin- 6-yl]benzoic acid | A | 2QYL | 0.7 | |
33P | {3-[(3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL)-AMINO]-2-METHYL- PROPYL}-PHOSPHONIC ACID | A | 1LC8 | 0.7 | |
KN1 | 4-[1-allyl-7-(trifluoromethyl)- 1H-indazol-3-yl]benzene-1,3-diol | A,B | 2QZO | 0.7 | |
DD1 | 5-{[1-(2-fluorobenzyl)piperidin- 4-yl]methoxy}quinazoline-2,4-diamine | A | 3BL7 | 0.7 | |
AI3 | 2,3-DIMETHOXY-12H-[1,3]DIOXOLO[5,6]INDENO[1,2- C]ISOQUINOLIN-6-IUM | A,C,D | 1TL8 | 0.7 | |
IHX | 3-[3-(4-methylpiperazin-1-yl)-7- (trifluoromethyl)quinoxalin-5-yl]phenol | A,B | 3F66 | 0.81 | |
QNO | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | C,D,E | 1NU1 | 0.84 | |
QNO | 2-NONYL-4-HYDROXYQUINOLINE N-OXIDE | A,B,C,D,G | 2E75 | 0.84 | |
LLF | (4-{(E)-[(2,2-DIFLUOROETHYL)IMINO]METHYL}- 5-HYDROXY-6-METHYLPYRIDIN-3-YL)METHYL DIHYDROGEN PHOSPHATE | A | 2G6W | 0.71 | |
1HP | 4-(2-amino-1-methyl-1H-imidazo[4,5- b]pyridin-6-yl)phenol | A,B | 2QSE | 0.73 | |
FLD | BIS-(N-ETHYLPYRIDINIUM-(3-METHOXYCARBAZOLE))HEXANE- 1,6-DIAMINE | A,B | 154D | 0.71 | |
HCP | 1-[((1E)-{3-HYDROXY-2-METHYL-5- [(PHOSPHONOOXY)METHYL]PYRIDIN-4- YL}METHYLENE)AMINO]CYCLOPENTYLPHOSPHONIC ACID | A | 1M0N | 0.71 | |
PLT | [3-HYDROXY-2-METHYL-5-PHOSPHONOOXYMETHYL- PYRIDIN-4-YLMETHYL]-L-TRYPTOPHANE | B | 2TYS | 0.71 | |
IMQ | (2R,3R,4S)-2-(hydroxymethyl)-1- (quinolin-8-ylmethyl)pyrrolidine- 3,4-diol | A,B | 3EPX | 0.75 | |
EPC | (1S)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]ETHYLPHOSPHONIC ACID | A,B | 2VD9 | 0.72 | |
EPC | (1S)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]ETHYLPHOSPHONIC ACID | A,B | 1FTX | 0.72 | |
EPC | (1S)-1-[((1E)-{3-HYDROXY-2-METHYL- 5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}METHYLENE)AMINO]ETHYLPHOSPHONIC ACID | A | 1M0Q | 0.72 | |
VAR | 9-amino-5-(2-aminopyrimidin-4-yl)pyrido[3',2':4,5]pyrrolo[1,2- c]pyrimidin-4-ol | A,B,C,D | 3BHV | 0.71 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RU9 | 0.76 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUM | 0.76 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUL | 0.76 | |
4HT | 4-HYDROXYTRYPTOPHAN | H,L | 1RUA | 0.76 | |
IOK | N-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]- 2-(2-PHENYL-1H-INDOL-3-YL)ACETAMIDE | A,B | 2IOK | 0.71 | |
HQO | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C | 1KQG | 0.84 | |
HQO | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,D,E,F | 2VR0 | 0.84 | |
HQO | 2-HEPTYL-4-HYDROXY QUINOLINE N- OXIDE | A,B,C,M,N,O,P | 1KF6 | 0.84 | |
132 | 6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE | H | 1O5E | 0.7 | |
132 | 6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE | B | 1GJ7 | 0.7 | |
132 | 6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE | H,I | 1GJ4 | 0.7 | |
132 | 6-CHLORO-2-(2-HYDROXY-BIPHENYL- 3-YL)-1H-INDOLE-5-CARBOXAMIDINE | A | 1GJ6 | 0.7 | |
8PC | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B | 2OP1 | 0.72 | |
8PC | 2-(2,4-DICHLOROPHENOXY)-5-(PYRIDIN- 2-YLMETHYL)PHENOL | A,B,C,D | 3FNE | 0.72 | |
SIE | SULFAMIC ACID 1-DECYL-2-(4-SULFAMOYLOXYPHENYL)- 1H-INDOL-6-YL ESTER | A | 2BRP | 0.77 | |
TTG | 2-(1-DIMETHYLAMINOMETHYL-2-HYDROXY- 8-HYDROXYMETHYL-9-OXO-9,11-DIHYDRO- INDOLIZINO[1,2-B]QUINOLIN-7-YL)- 2-HYDROXY-BUTYRIC ACID | A,B | 1RRJ | 0.71 | |
TTG | 2-(1-DIMETHYLAMINOMETHYL-2-HYDROXY- 8-HYDROXYMETHYL-9-OXO-9,11-DIHYDRO- INDOLIZINO[1,2-B]QUINOLIN-7-YL)- 2-HYDROXY-BUTYRIC ACID | A,C,D | 1K4T | 0.71 | |
TTG | 2-(1-DIMETHYLAMINOMETHYL-2-HYDROXY- 8-HYDROXYMETHYL-9-OXO-9,11-DIHYDRO- INDOLIZINO[1,2-B]QUINOLIN-7-YL)- 2-HYDROXY-BUTYRIC ACID | A,C | 1RR8 | 0.71 | |
R69 | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH4 | 0.71 | |
R69 | N-[4-({4-[5-(DIMETHYLAMINO)-2-HYDROXYBENZOYL]BENZOYL}AMINO)AZEPAN- 3-YL]ISONICOTINAMIDE | A | 1XH9 | 0.71 | |
6EA | (1S)-1-(1H-INDOL-3-YLMETHYL)-2- (2-PYRIDIN-4-YL-[1,7]NAPHTYRIDIN- 5-YLOXY)-EHYLAMINE | E | 2F7Z | 0.71 | |
ROS | N,N'-TETRAMETHYL-ROSAMINE | A | 1F1T | 0.72 | |
NPM | N-[(1E)-PYRIDIN-2-YLMETHYLENE]- N-[4-(4-{[(1E)-PYRIDIN-2-YLMETHYLENE]AMINO}BENZYL)PHENYL]AMINE | A,B | 2ET0 | 0.72 | |
FOO | (3E)-4-{3-HYDROXY-2-METHYL-5-[(PHOSPHONOOXY)METHYL]PYRIDIN- 4-YL}-2-IMINOBUT-3-ENOIC ACID | B | 2J9Y | 0.71 | |
EI1 | 3-ETHYL-2-(4-HYDROXYPHENYL)-2H- INDAZOL-5-OL | A,B | 2QAB | 0.71 | |
772 | 2-CYANOQUINOLIN-8-YL DIHYDROGEN PHOSPHATE | A | 1O4H | 0.71 | |
HQA | 3-(8-hydroxyquinolin-3-yl)-L-alanine | A,B | 3FCA | 0.77 | |
POF | (4aS,4bR,10bS,12aS)-12a-methyl- 1,3-dioxo-2-(pyridin-3-ylmethyl)- 1,2,3,4,4a,4b,5,6,10b,11,12,12a- dodecahydronaphtho[2,1-f]isoquinolin- 8-yl sulfamate | A | 3C7P | 0.71 | |
I3N | 1-BENZYL-5-METHOXY-2-METHYL-1H- INDOL-3-YL)-ACETIC ACID | A | 1DCY | 0.71 |