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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01045365

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
CXZ4-chloro-6-{5-[(2-morpholin-4-ylethyl)amino]-
1,2-benzisoxazol-3-yl}benzene-1,3-
diol
A3BMY0.71
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1JWZ0.75
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A,B1FSY0.75
105N-[5-METHYL-3-O-TOLYL-ISOXAZOLE-
4-CARBOXYLIC ACID AMIDE] BORONIC ACID
A1NYY0.75
COX4-(5-METHYL-3-PHENYLISOXAZOL-4-
YL)BENZENESULFONAMIDE
A2AW10.73
2GJ5-[2,4-DIHYDROXY-5-(1-METHYLETHYL)PHENYL]-
N-ETHYL-4-[4-(MORPHOLIN-4-YLMETHYL)PHENYL]ISOXAZOLE-
3-CARBOXAMIDE
A2VCI0.76
8261,3,4,9-TETRAHYDRO-2-(HYDROXYBENZOYL)-
9-[(4-HYDROXYPHENYL)METHYL]-6-METHOXY-
2H-PYRIDO[3,4-B]INDOLE
A,B1I300.72
PXBparecoxibA2ZMB0.76
BXZ4-bromo-6-(6-hydroxy-1,2-benzisoxazol-
3-yl)benzene-1,3-diol
A3BM90.72
6C36-CHLORO-3-(3-METHYLISOXAZOL-5-
YL)-4-PHENYLQUINOLIN-2(1H)-ONE
A2I0V0.71
IOKN-[(1R)-3-(4-HYDROXYPHENYL)-1-METHYLPROPYL]-
2-(2-PHENYL-1H-INDOL-3-YL)ACETAMIDE
A,B2IOK0.72
19B4-methyl-N-(3-morpholin-4-ylphenyl)-
3-(3-piperidin-4-yl-1,2-benzisoxazol-
6-yl)benzamide
A3E930.8
7973-(6-HYDROXY-NAPHTHALEN-2-YL)-BENZO[D]ISOOXAZOL-
6-OL
A,B1U3S0.74
2EQ5-(5-chloro-2,4-dihydroxyphenyl)-
N-ethyl-4-[4-(morpholin-4-ylmethyl)phenyl]isoxazole-
3-carboxamide
A2VCJ0.71
76A3-(4'-HYDROXYBIPHENYL-4-YL)-N-(4-
HYDROXYCYCLOHEXYL)-1,4-DIHYDROINDENO[1,2-
C]PYRAZOLE-6-CARBOXAMIDE
A2E9N0.7
AG74-{2-(4-FLUORO-BENZYL)-6-METHYL-
5-[(5-METHYL-ISOXAZOLE-3-CARBONYL)-
AMINO]-4-OXO-HEPTANOYLAMINO}-5-
(2-OXO-PYRROLIDIN-3-YL)-PENTANOIC ACID ETHYL ESTER
A1CQQ0.74
2GG5-(5-CHLORO-2,4-DIHYDROXYPHENYL)-
N-ETHYL-4-(4-METHOXYPHENYL)ISOXAZOLE-
3-CARBOXAMIDE
A2UWD0.72
2724-(6-HYDROXY-BENZO[D]ISOXAZOL-3-
YL)BENZENE-1,3-DIOL
A,B,C,D1U3Q0.77
GNI(3-{4-[2-(2,4-DICHLORO-PHENOXY)-
ETHYLCARBAMOYL]-5-PHENYL-ISOXAZOL-
3-YL}-PHENYL)-ACETIC ACID
A,B2J140.71
3IHN-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-
L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-
4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-
3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
A2HOB0.73
3IHN-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-
L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-
4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-
3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
A,B2AMQ0.73
3IHN-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-
L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-
4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-
3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
A,B,C,D3D230.73
3IHN-[(5-METHYLISOXAZOL-3-YL)CARBONYL]ALANYL-
L-VALYL-N~1~-((1R,2Z)-4-(BENZYLOXY)-
4-OXO-1-{[(3R)-2-OXOPYRROLIDIN-
3-YL]METHYL}BUT-2-ENYL)-L-LEUCINAMIDE
A,B2Q6F0.73