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Ligands with its PDB code and its tanimoto calculated from the molecule, present in the database, which has for MMscode: MMs01389879

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
PI7N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-
OXA-6,9-DIAZA-BICYCLO[11.2.2] HEPTADECA-
1(16),13(17),14-TRIEN-11-YAMINO)-
2-HYDROXY-1-(4-HYDROXY-BENZYL) -
PROPYL]-3-METHYL-2-PROPIONYLAMINO-
BUTYRAMIDE		A,B1B6P0.7
PI8N-13-[(10S,13S)-9,12-DIOXO-10-(2-
BUTYL)-2-OXA-8,11-DIAZABICYCLO [13.2.2] NONADECA-
15,17,18-TRIENE] (2R)-BENZYL-(4S)-
HYDROXY-5-AMINOPENTANOIC (1R)-HYDROXY-
(2S)-INDANEAMIDE		A,B1D4K0.72
A5T(1R,5S)-7-{4-[3-(2-chloro-3,6-difluorophenoxy)propyl]phenyl}-
N-cyclopropyl-N-(2,3-dichlorobenzyl)-
3,9-diazabicyclo[3.3.1]non-6-ene-
6-carboxamide		A,B3G700.7
SBISORBINILA1AH00.82
SBISORBINILA2PDK0.82
CNE(3S)-5-[(2-CHLORO-6-FLUOROBENZYL)SULFANYL]-
3-{[N-({2-ETHOXY-5-[(1E)-3-METHOXY-
3-OXOPROP-1-ENYL]PHENYL}ACETYL)-
D-VALYL]AMINO}-4-OXOPENTANOIC ACID		A1RHR0.7
DBON-{(1S,2R)-1-BENZYL-2-HYDROXY-3-
[(3-METHYLBENZYL)AMINO]PROPYL}DIBENZO[B,F]OXEPINE-
10-CARBOXAMIDE		A,B,C,D2EWY0.7
PI41-[2-(8-CARBAMOYLMETHYL-6,9-DIOXO-
2-OXA-7,10-DIAZA-BICYCLO[11.2.2]HEPTADECA-
1(16),13(17),14-TRIEN-11-YL)-2-
HYDROXY-ETHYL]-PIPERIDINE-2-CARBOXYLIC ACID TERT-
BUTYLAMIDE		A,B1B6L0.71
BN27-[2,6-DICHLORO-4-({[(2-CHLOROBENZOYL)AMINO]CARBONYL}AMINO)PHENOXY]HEPTANOIC ACIDA1WUT0.71
L75N-[2(R)-HYDROXY-1(S)-INDANYL]-2(R)-
PHENYLMETHYL-4(S)-HYDROXY-5-[4-
[2-BENZOFURANYLMETHYL]-2(S)-[TERT-
BUTYLAMINOCARBONYL]-PIPERAZINYL]-
PENTANEAMIDE		B1C700.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2Q5K0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2QHC0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2RKF0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		B1MUI0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		B1RV70.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2RKG0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2O4S0.71
AB1N-{1-BENZYL-4-[2-(2,6-DIMETHYL-
PHENOXY)-ACETYLAMINO]-3-HYDROXY-
5-PHENYL-PENTYL}-3-METHYL-2-(2-
OXO-TETRAHYDRO-PYRIMIDIN-1-YL)-
BUTYRAMIDE		A,B2Z540.71
1771-[2-AMINO-2-CYCLOHEXYL-ACETYL]-
PYRROLIDINE-3-CARBOXYLIC ACID 5-
CHLORO-2-(2-ETHYLCARBAMOYL-ETHOXY)-
BENZYLAMIDE		A,B1TA60.82
ACF3-{[(2R,5S)-5-{[(2S)-2-(AMINOMETHYL)PYRROLIDIN-
1-YL]CARBONYL}PYRROLIDIN-2-YL]METHOXY}-
4-CHLOROBENZOIC ACID		A2G5T0.74
TF3N-(2-AMINOETHYL)-2-{3-CHLORO-4-
[(4-ISOPROPYLBENZYL)OXY]PHENYL} ACETAMIDE		A2BU70.79
A7T(1R,5S)-N-cyclopropyl-7-{4-[2-(2,6-
dichloro-4-methylphenoxy)ethoxy]phenyl}-
N-(2,3-dimethylbenzyl)-3,9-diazabicyclo[3.3.1]non-
6-ene-6-carboxamide		A,B3G6Z0.72
FIR(2R,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A1X970.8
T76(6R,21AS)-17-CHLORO-6-CYCLOHEXYL-
2,3,6,7,10,11,19,20-OCTAHYDRO-1H,5H-
PYRROLO[1,2-K][1,4,8,11,14]BENZOXATETRAAZA-
CYCLOHEPTADECINE-5,8,12,21(9H,13H,21AH)-
TETRONE		A,H1NT10.81
DCH3-(7-DIAMINOMETHYL-NAPHTHALEN-2-
YL)-PROPIONIC ACID ETHYL ESTER		H1UVU0.72
XNI(11S)-10-acetyl-11-[4-(benzyloxy)-
3-chlorophenyl]-3,3-dimethyl-2,3,4,5,10,11-
hexahydro-1H-dibenzo[b,e][1,4]diazepin-
1-one		A,B3CSO0.7
14AN-ALLYL-5-AMIDINOAMINOOXY-PROPYLOXY-
3-CHLORO-N-CYCLOPENTYLBENZAMIDE		H,I1T4V0.72
9971-[3,3-DIMETHYL-2-(2-METHYLAMINO-
PROPIONYLAMINO)-BUTYRYL]-4-PHENOXY-
PYRROLIDINE-2-CARBOXYLIC ACID(1,2,3,4-
TETRAHYDRO-NAPHTHALEN-1-YL)-AMIDE		A1TFT0.78
PI5N-[3-(8-SEC-BUTYL-7,10-DIOXO-2-
OXA-6,9-DIAZA-BICYCLO[11.2.2]HEPTADECA-
1(16),13(17),14- TRIEN-11-YLAMINO)-
2-HYDROXY-1-(4-HYDROXY-BENZYL)-
PROPYL]-3-METHYL-2- (2-OXO-PYRROLIDIN-
1-YL)-BUTYRAMIDE		A,B1B6K0.72
NHNA,C2GVF0.76
DRRA,B3BXR0.71
A6T(1S,5R)-7-{4-[3-(2-chloro-3,6-difluorophenoxy)propyl]phenyl}-
N-cyclopropyl-N-(2,3-dichlorobenzyl)-
3,9-diazabicyclo[3.3.1]non-6-ene-
6-carboxamide		A,B3G720.7
D564-(2-aminoethoxy)-N-(3-chloro-2-
ethoxy-5-piperidin-1-ylphenyl)-
3,5-dimethylbenzamide		A2VIW0.71
FIS(2S,4R)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A3BCJ0.8
FIS(2S,4R)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A1X980.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PDW0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2AGT0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PF80.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PFH0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A1PWM0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PEV0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PDY0.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A,B1EF30.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A2PD90.8
FID(2S,4S)-2-AMINOFORMYL-6-FLUORO-
SPIRO[CHROMAN-4,4'-IMIDAZOLIDINE]-
2',5'-DIONE		A3H4G0.8