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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs03105248

You can sort the columns by Ligand, Ligand name, PDB and Tanimoto.


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
2D7N-(4-ACETYLPHENYL)-5-(5-CHLORO-
2,4-DIHYDROXYPHENYL)-1H-PYRAZOLE-
4-CARBOXAMIDE
A2BYH0.71
310N-carbamimidoyl-2-[2-(2-chlorophenyl)-
5-[4-(4-ethanoylphenoxy)phenyl]pyrrol-
1-yl]ethanamide
A2ZDZ0.72
2DD3-(5-CHLORO-2,4-DIHYDROXY-PHENYL)-
1H-PYRAZOLE-4-CARBOXYLIC ACID 4-
SULFAMOYL-BENZYLAMIDE
A2BYI0.71
PQA[5-AMINO-1-(4-FLUOROPHENYL)-1H-
PYRAZOL-4-YL][3-(PIPERIDIN-4-YLOXY)PHENYL]METHANONE
A2BAL0.71
4FR3'-chloro-5'-[6-({2-methoxy-4-[(1-
methylpiperidin-4-yl)carbamoyl]phenyl}amino)-
3-methyl-1H-pyrazolo[4,3-c]pyridin-
1-yl]biphenyl-2-carboxamide
A3DBE0.71
JK23-{5-[(2-fluorophenyl)amino]-1H-
indazol-1-yl}-N-(3,4,5-trimethoxyphenyl)benzamide
A3FI30.71
NSI3-(4-METHOXYPHENYL)-N-(PHENYLSULFONYL)-
1-[3-(TRIFLUOROMETHYL)BENZYL]-1H-
INDOLE-2-CARBOXAMIDE
A2HFP0.72
JK13-{4-[(phenylcarbamoyl)amino]-1H-
pyrazol-1-yl}-N-(3,4,5-trimethoxyphenyl)benzamide
A3FI20.71
792N-{[4-(but-2-yn-1-yloxy)phenyl]sulfonyl}-
5-methyl-D-tryptophan
A,B,C,D3G420.7
5FR4-({1-[3-(3-amino-3-oxopropyl)-
5-chlorophenyl]-3-methyl-1H-pyrazolo[4,3-
c]pyridin-6-yl}amino)-3-methoxy-
N-(1-methylpiperidin-4-yl)benzamide
A3DBF0.7
VIA5-{2-ETHOXY-5-[(4-METHYLPIPERAZIN-
1-YL)SULFONYL]PHENYL}-1-METHYL-
3-PROPYL-1H,6H,7H-PYRAZOLO[4,3-
D]PYRIMIDIN-7-ONE
A1XOS0.71
VIA5-{2-ETHOXY-5-[(4-METHYLPIPERAZIN-
1-YL)SULFONYL]PHENYL}-1-METHYL-
3-PROPYL-1H,6H,7H-PYRAZOLO[4,3-
D]PYRIMIDIN-7-ONE
A1TBF0.71
VIA5-{2-ETHOXY-5-[(4-METHYLPIPERAZIN-
1-YL)SULFONYL]PHENYL}-1-METHYL-
3-PROPYL-1H,6H,7H-PYRAZOLO[4,3-
D]PYRIMIDIN-7-ONE
A,B,C2H420.71
VIA5-{2-ETHOXY-5-[(4-METHYLPIPERAZIN-
1-YL)SULFONYL]PHENYL}-1-METHYL-
3-PROPYL-1H,6H,7H-PYRAZOLO[4,3-
D]PYRIMIDIN-7-ONE
A1UDT0.71
FRI2-GUANIDINO-4-METHYL-PENTANOIC ACID [2-
(4-{5-[4-(4-ACETYLAMINO-BENZYLOXY)-
2,3-DICHLORO-PHENYL]-2-METHYL-2H-
PYRAZOL-3-YL}-PIPERIDIN-1-YL)-2-
OXO-ETHYL]-AMIDE
A,B,C,D1QVN0.7
A83TERT-BUTYL 4-[({[1-((1S,2R)-1-BENZYL-
2-HYDROXY-3-{ISOBUTYL[(4-METHOXYPHENYL)SULFONYL]AMINO}PROPYL)-
1H-1,2,3-TRIAZOL-4-YL]METHYL}AMINO)CARBONYL]BENZYLCARBAMATE
A1ZPA0.72
900N-(4-chlorophenyl)-6-[(6,7-dimethoxyquinolin-
4-yl)oxy]naphthalene-1-carboxamide
A,B3B8Q0.71
WAYN-HYDROXY-2-[(4-METHOXY-BENZENESULFONYL)-
PYRIDIN-3-YLMETHYL-AMINO]-3-METHYL-
BENZAMIDE
A1FLS0.72
WAYN-HYDROXY-2-[(4-METHOXY-BENZENESULFONYL)-
PYRIDIN-3-YLMETHYL-AMINO]-3-METHYL-
BENZAMIDE
A1FM10.72
337N-benzyl-1-[5-({5-tert-butyl-2-
methoxy-3-[(methylsulfonyl)amino]phenyl}carbamoyl)-
2-methylphenyl]-1H-1,2,3-triazole-
4-carboxamide
A3CTQ0.71
I1H3-[2-(2,4-DICHLOROPHENYL)ETHOXY]-
4-METHOXY-N-[(1-PYRIDIN-4-YLPIPERIDIN-
4-YL)METHYL]BENZAMIDE
B2BMG0.71