MMsINC Database Search
logo   logo
logo Search | Help | MolPaint | Roadmap | Credits | Feedback


Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs00015071

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
KSAK-252AA1R0P1
KSAK-252AA3EQF1
XDRhexyl (5S,6R,8R)-6-hydroxy-5-methyl-
13-oxo-5,6,7,8-tetrahydro-13H-5,8-
epoxy-4b,8a,14-triazadibenzo[b,h]cycloocta[1,2,3,4-
jkl]cyclopenta[e]-as-indacene-6-
carboxylate		A,B3F690.93
STUSTAUROSPORINEA,B3CBL0.86
STUSTAUROSPORINEA1QPJ0.86
STUSTAUROSPORINEA,B3CD30.86
STUSTAUROSPORINEA2ITU0.86
STUSTAUROSPORINEA,B2BUJ0.86
STUSTAUROSPORINEA,B2CLQ0.86
STUSTAUROSPORINEA1XBC0.86
STUSTAUROSPORINEA2ITW0.86
STUSTAUROSPORINEA1E8Z0.86
STUSTAUROSPORINEA1YHS0.86
STUSTAUROSPORINEA,B3D7T0.86
STUSTAUROSPORINEA1QPD0.86
STUSTAUROSPORINEA2Z7R0.86
STUSTAUROSPORINEA,B,C,D2NRY0.86
STUSTAUROSPORINEA1U590.86
STUSTAUROSPORINEA1NVR0.86
STUSTAUROSPORINEA,B,C,D2OIC0.86
STUSTAUROSPORINEA1AQ10.86
STUSTAUROSPORINEA1BYG0.86
STUSTAUROSPORINEA,B1SM20.86
STUSTAUROSPORINEX2DQ70.86
STUSTAUROSPORINEA3CKX0.86
STUSTAUROSPORINEA,B1Q3D0.86
STUSTAUROSPORINEE1STC0.86
STUSTAUROSPORINEA1OKY0.86
STUSTAUROSPORINEA1WVY0.86
STUSTAUROSPORINEA2HW70.86
STUSTAUROSPORINEA,B1SNU0.86
STUSTAUROSPORINEA2ITQ0.86
STUSTAUROSPORINEA,B,C,D1NXK0.86
STUSTAUROSPORINEA3BKB0.86
STUSTAUROSPORINEA1XJD0.86
STUSTAUROSPORINEA3FME0.86
STUSTAUROSPORINEA,B2GCD0.86
STUSTAUROSPORINEA,B,C2PZY0.86
UCMREL-(9R,12S)-9,10,11,12-TETRAHYDRO-
9,12-EPOXY-1H-DIINDOLO[1,2,3-FG:3',2',1'-
KL]PYRROLO[3,4-I][1,6]BENZODIAZOCINE-
1,3(2H)-DIONE		A1NVS0.86
4ST1,2,3,4-TETRAHYDROGEN-STAUROSPORINEA2J0J0.86
4ST1,2,3,4-TETRAHYDROGEN-STAUROSPORINEB2J0M0.86
4ST1,2,3,4-TETRAHYDROGEN-STAUROSPORINEA,B2J0K0.86
4ST1,2,3,4-TETRAHYDROGEN-STAUROSPORINEA1YVJ0.86
4ST1,2,3,4-TETRAHYDROGEN-STAUROSPORINEA,B,C2HZ40.86
UCN7-HYDROXYSTAUROSPORINEA1OKZ0.84
UCN7-HYDROXYSTAUROSPORINEA,C1PKD0.84
UCN7-HYDROXYSTAUROSPORINEA1NVQ0.84
1ST(5S,6R,7R,9R)-12-HYDROXY-6-METHOXY-
5-METHYL-7-(METHYLAMINO)-6,7,8,9-
TETRAHYDRO-5H,14H-5,9-EPOXY-4B,9A,15-
TRIAZADIBENZO[B,H]CYCLONONA[1,2,3,4-
JKL]CYCLOPENTA[E]-AS-INDACEN-14-
ONE		12HY80.77
K2C6,7,12,13-tetrahydro-5H-indolo[2,3-
a]pyrrolo[3,4-c]carbazol-5-one		A2R0P0.76
SA32,10-DIHYDROXY-12-(BETA-D-GLUCOPYRANOSYL)-
6,7,12,13-TETRAHYDROINDOLO[2,3-
A]PYRROLO[3,4-C]CARBAZOLE-5,7-DIONE		A,C,D1SEU0.76
AG1RUTHENIUM PYRIDOCARBAZOLEA,B2JLD0.74
BD46-(3-AMINOPROPYL)-4,9-DIMETHYLPYRROLO[3,4-
C]CARBAZOLE-1,3(2H,6H)-DIONE		A1WVX0.73
8393-(9-HYDROXY-1,3-DIOXO-4-PHENYL-
2,3-DIHYDROPYRROLO[3,4-C]CARBAZOL-
6(1H)-YL)PROPANOIC ACID		A2IN60.73
CM7N-[(1S,2R)-1-benzyl-2-hydroxy-3-
{[3-(trifluoromethyl)benzyl]amino}propyl]-
7-ethyl-1-methyl-3,4-dihydro-1H-
[1,2,5]thiadiazepino[3,4,5-hi]indole-
9-carboxamide 2,2-dioxide		A2VNN0.72
CMF3-CYCLOHEXYL-1-(2-MORPHOLIN-4-YL-
2-OXOETHYL)-2-PHENYL-1H-INDOLE-
6-CARBOXYLIC ACID		A2BRK0.72
FRNA2CV30.71
DFN3-[3-(2,3-DIHYDROXY-PROPYLAMINO)-
PHENYL]-4-(5-FLUORO-1-METHYL-1H-
INDOL-3-YL)-PYRROLE-2,5-DIONE		A,B1R0E0.71
IPFN-ACETYLTRYPTOPHYL-N~1~-{3-[1-(N-
ACETYLTRYPTOPHYLVALYL)PYRROLIDIN-
2-YL]-1-BENZYL-2,3-DIHYDROXYPROPYL}VALINAMIDE		A,B2A1E0.71
LY4(9R)-9-[(DIMETHYLAMINO)METHYL]-
6,7,10,11-TETRAHYDRO-9H,18H-5,21:12,17-
DIMETHENODIBENZO[E,K]PYRROLO[3,4-
H][1,4,13]OXADIAZACYCLOHEXADECINE-
18,20-DIONE		B2J2I0.71
LY4(9R)-9-[(DIMETHYLAMINO)METHYL]-
6,7,10,11-TETRAHYDRO-9H,18H-5,21:12,17-
DIMETHENODIBENZO[E,K]PYRROLO[3,4-
H][1,4,13]OXADIAZACYCLOHEXADECINE-
18,20-DIONE		A1UU30.71
SNX2-[(2-methoxyethyl)amino]-4-(4-
oxo-1,2,3,4-tetrahydro-9H-carbazol-
9-yl)benzamide		A3D0B0.71
ZY4N-[(1S)-1-BENZYL-2,2-DIHYDROXY-
3-(TETRAHYDRO-2H-PYRAN-4-YLAMINO)PROPYL]-
6-ETHYL-1-METHYL-1,3,4,6-TETRAHYDRO[1,2]THIAZEPINO[5,4,3-
CD]INDOLE-8-CARBOXAMIDE 2,2-DIOXIDE		A2WF40.71
3964-(2-chlorophenyl)-9-hydroxy-6-
methyl-1,3-dioxo-N-(2-pyrrolidin-
1-ylethyl)pyrrolo[3,4-g]carbazole-
8-carboxamide		A3BI60.71
THXA1AUL0.71
JTPN-[(13-CYCLOHEXYL-6,7-DIHYDROINDOLO[1,2-
D][1,4]BENZOXAZEPIN-10-YL)CARBONYL]-
2-METHYL-L-ALANINE		A,B2DXS0.71
ME3RUTHENIUM-PYRIDOCARBAZOLE-3A2BZJ0.71
HR1(3R,5R)-7-[1-(4-FLUOROPHENYL)-3-
ISOPROPYL-4-OXO-5-PHENYL-4,5-DIHYDRO-
3H-PYRROLO[2,3-C]QUINOLIN-2-YL]-
3,5-DIHYDROXYHEPTANOIC ACID		A,B,C,D2Q6C0.7
FLLOCTAHEDRAL RU-PYRIDOCARBAZOLEA3FXZ0.7
C80(2S,4S,5R,7R)-4-AMINO-8-(BUTYLAMINO)-
5-HYDROXY-2,7-DIMETHYL-8-OXOOCTYL 1-
BENZYL-1H-INDOLE-3-CARBOXYLATE		C,O2V110.7
KAWN-{(5S)-4,4-dihydroxy-6-phenyl-
5-[(phenylcarbonyl)amino]hexanoyl}-
L-tryptophan		A3BKL0.7