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: MMs03413597

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


LigandLigand nameChainPDBTanimotoLigand in PDB
LigandLigand nameChainPDBTanimotoLigand in PDB
S2DN-BENZOYL-D-ALANINEA,B2JCI0.76
KHA1-(4-{[(2-HYDROXYETHYL)AMINO]CARBONYL}BENZYL)-
1-METHYLPIPERIDINIUM		H,L,X,Y1UWG0.7
4PIN-(4-METHYLBENZOYL)-4-BENZYLPIPERIDINEA,B2NSD0.71
TMM1,3,5-BENZENETRICARBOXYLIC ACIDA,B,C,D1SDL0.75
TMM1,3,5-BENZENETRICARBOXYLIC ACIDA,B,C,D1SDK0.75
4AF4-ACETYL-L-PHENYLALANINEA1ZH60.7
821A1O430.7
BEZBENZOIC ACIDA,B2F8D0.73
BEZBENZOIC ACIDA,B1A8U0.73
BEZBENZOIC ACIDA,B1REE0.73
BEZBENZOIC ACIDA1L7Q0.73
BEZBENZOIC ACIDA1I690.73
BEZBENZOIC ACIDH,L1RUL0.73
BEZBENZOIC ACIDA,B3CCF0.73
BEZBENZOIC ACIDA1W9Q0.73
BEZBENZOIC ACIDA,B,G,J2DU80.73
BEZBENZOIC ACIDH,L1RUA0.73
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		1H4O0.73
BEZBENZOIC ACIDH,L1RU90.73
BEZBENZOIC ACIDA,B,C,D2V320.73
BEZBENZOIC ACIDA2QMQ0.73
BEZBENZOIC ACIDA1UKB0.73
BEZBENZOIC ACIDA,B1RED0.73
BEZBENZOIC ACIDA,B1OC30.73
BEZBENZOIC ACIDA,B1REF0.73
BEZBENZOIC ACIDA,B2O020.73
BEZBENZOIC ACIDA,B2VJ10.73
BEZBENZOIC ACIDA,B,C1WSP0.73
BEZBENZOIC ACIDA1HZ40.73
BEZBENZOIC ACIDA2Q380.73
BEZBENZOIC ACIDA,B,C,D1UUJ0.73
BEZBENZOIC ACIDA,B2QL80.73
BEZBENZOIC ACIDA2Q0I0.73
BEZBENZOIC ACIDA,B1S8F0.73
BEZBENZOIC ACIDD,E,F,G,H1DJR0.73
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H,I		1ONI0.73
BEZBENZOIC ACIDA,B,C,D1I7Q0.73
BEZBENZOIC ACIDA,B,C,D2RHM0.73
BEZBENZOIC ACIDA,B2F780.73
BEZBENZOIC ACIDA,B2VL20.73
BEZBENZOIC ACIDA1HD20.73
BEZBENZOIC ACIDA1JU40.73
BEZBENZOIC ACIDH,L2AJY0.73
BEZBENZOIC ACIDA,B,C3GV10.73
BEZBENZOIC ACIDA2Q6U0.73
BEZBENZOIC ACIDA,B1VE90.73
BEZBENZOIC ACIDA,B1S9A0.73
BEZBENZOIC ACIDH,L,M1OP30.73
BEZBENZOIC ACIDA1W9E0.73
BEZBENZOIC ACIDA,B,C,D2V2G0.73
BEZBENZOIC ACIDH,L2AK10.73
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		2V410.73
BEZBENZOIC ACIDA,B1GYX0.73
BEZBENZOIC ACIDA1V1T0.73
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H,I,J,K,L		1YAJ0.73
BEZBENZOIC ACIDA,B1HKQ0.73
BEZBENZOIC ACIDH,L1RUK0.73
BEZBENZOIC ACIDA2Q1B0.73
BEZBENZOIC ACIDH,L1RUM0.73
BEZBENZOIC ACIDA,B2F7A0.73
BEZBENZOIC ACIDA,B,C,D,E,F,
G,H		1KIF0.73
BEZBENZOIC ACIDA,B2V7B0.73
BEZBENZOIC ACIDH1NCW0.73
BEZBENZOIC ACIDA,B1TMX0.73
BEZBENZOIC ACIDA1URM0.73
BEZBENZOIC ACIDA1W9O0.73
BEZBENZOIC ACIDA,B,C,D1GXS0.73
BEZBENZOIC ACIDH1RUP0.73
BEZBENZOIC ACIDA,B,C,D1KQB0.73
BEZBENZOIC ACIDA2Q9R0.73
BEZBENZOIC ACIDD,H2OK60.73
BEZBENZOIC ACIDA,B2Q0J0.73
NDLN-BENZOYL-L-NORLEUCYL-L-LYSYL-L-
ARGINYL-L-ARGININE		B2FP70.71
AJH4-({4-[(3R)-3-amino-4-(2,4,5-trifluorophenyl)butanoyl]-
1,4-diazepan-1-yl}carbonyl)benzoic acid		A,B3EIO0.75
MRE2-(4-DIMETHYLAMINOPHENYL)DIAZENYLBENZOIC ACIDA,B2V9C0.73
XP14-(DIMETHYLAMINO)BENZOIC ACIDA,B2VJ10.8
XP14-(DIMETHYLAMINO)BENZOIC ACIDA2V6N0.8
SP8N-{(1S)-3-[(4-aminobutyl)amino]-
1-methylpropyl}benzamide		A,B3CNS0.7
GAB3-AMINOBENZOIC ACIDA,B,C,D,E,F2PQF0.71
GAB3-AMINOBENZOIC ACIDA,B3GSB0.71
GAB3-AMINOBENZOIC ACIDA,B,C1GBN0.71
GAB3-AMINOBENZOIC ACIDA3FHB0.71
VBP4-({3-[(2R)-2-amino-2-carboxyethyl]-
2,6-dioxo-3,6-dihydropyrimidin-
1(2H)-yl}methyl)benzoic acid		B,E,G,H,J,L,
N,P		3H060.74
ITB2-(CARBOXYMETHYL)-1-OXO-1,2-DIHYDRONAPHTHO[1,2-
D]ISOTHIAZOLE-4-CARBOXYLIC ACID 3,3-
DIOXIDE		A2NVD0.74
RA21-[4-CARBOXY-2-(3-PENTYLAMINO)PHENYL]-
5,5'-DI(HYDROXYMETHYL)PYRROLIDIN-
2-ONE		A1B9V0.7
4MB4-[(METHYLSULFONYL)AMINO]BENZOIC ACIDA,B2HDS0.71
FE34-(2-aminoethyl)-3-chlorobenzoic acidA,B2K1Q0.71
HGB4-(HYDROXYMERCURY)BENZOIC ACIDA1F2W0.73
HGB4-(HYDROXYMERCURY)BENZOIC ACIDA2F140.73
HGB4-(HYDROXYMERCURY)BENZOIC ACIDA1BV30.73
HGB4-(HYDROXYMERCURY)BENZOIC ACIDA2AW10.73
HGB4-(HYDROXYMERCURY)BENZOIC ACIDA1ZE80.73
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B1KDG0.71
EMT2-(ETHYLMERCURI-THIO)-BENZOIC ACIDA,B,C,D1O9L0.71
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL		H,L1D6V0.73
HOP(1S,2S,5S)2-(4-GLUTARIDYLBENZYL)-
5-PHENYL-1-CYCLOHEXANOL		A,B,H,L1AXS0.73
MPQN-METHYL-ALPHA-PHENYL-GLYCINED1D6E0.73
BJH1(R)-1-ACETAMIDO-2-(3-CARBOXY-2-
HYDROXYPHENYL)ETHYL BORONIC ACID		A1ERQ0.77
OBA2-(OXALYL-AMINO)-BENZOIC ACIDA1C850.7
ST54-(ACETYLAMINO)-3-[(HYDROXYACETYL)AMINO]BENZOIC ACIDA,B1ING0.7
IBA4-[(2R)-2-(AMINOMETHYL)-2-(HYDROXYMETHYL)-
5-OXOPYRROLIDIN-1-YL]-3-[(1-ETHYLPROPYL)AMINO]BENZOIC ACID		A1VCJ0.7
ST44-(ACETYLAMINO)-3-GUANIDINOBENZOIC ACIDA1INF0.72
3XH3-Hydroxyhippuric acidA3E9K0.77
23C2-[(1R)-1-carboxy-2-naphthalen-
1-ylethyl]-1,3-dioxo-2,3-dihydro-
1H-isoindole-5-carboxylic acid		A,B2R9W0.78
8522-{4-[2-ACETYLAMINO-2-(1-BIPHENYL-
4-YLMETHYL-2-OXO-AZEPAN-3-YLCARBAMOYL)-
ETHYL]-2-CARBOXY-PHENYL}-MALONIC ACID		A1O440.74
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFK0.72
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZFQ0.72
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1Z9Y0.72
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZH90.72
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGE0.72
BE7(4-CARBOXYPHENYL)(CHLORO)MERCURYA1ZGF0.72
ST64-(ACETYLAMINO)-3-[(AMINOACETYL)AMINO]BENZOIC ACIDA,B1INH0.74
IFBN-[(2',4'-DIFLUORO-4-HYDROXY-5-
IODOBIPHENYL-3-YL)CARBONYL]-BETA-
ALANINE		A,B3FCB0.72
FCK3-({[3-({[(1E)-(2,6-dioxo-1,2,3,6-
tetrahydropyrimidin-4-yl)methylidene]amino}oxy)propyl]amino}methyl)benzoic acid		B3FCK0.74
PY94-{[(2R)-2-(2-methylphenyl)pyrrolidin-
1-yl]carbonyl}benzene-1,3-diol		A,B3EKR0.73
OSB2-SUCCINYLBENZOATEA1FHV0.7
OSB2-SUCCINYLBENZOATEA,B,C,D1SJB0.7
OSB2-SUCCINYLBENZOATEA,B2QVH0.7
BJP(1R)-2-PHENYLACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACIDA1ERO0.82
YC2N-{[(1S)-1-carboxy-5-{[(4-iodophenyl)carbonyl]amino}pentyl]carbamoyl}-
L-glutamic acid		A3D7H0.71
HBD4-HYDROXYBENZAMIDEB,C,D1BEN0.73
PG9D-PHENYLGLYCINEA,B,G,H10GS0.71
PG9D-PHENYLGLYCINEA,B,C,D2B4K0.71
SCLACETIC ACID SALICYLOYL-AMINO-ESTERA1EBV0.73
FDI4-(N-ACETYLAMINO)-3-[N-(2-ETHYLBUTANOYLAMINO)]BENZOIC ACIDA1B9S0.73
4BA4-[(2-CARBOXY-ETHYLAMINO)-METHYL]-
BENZOIC ACID		C1FAV0.82
WH62-[(1R)-2-carboxy-1-(naphthalen-
1-ylmethyl)ethyl]-1,3-dioxo-2,3-
dihydro-1H-isoindole-5-carboxylic acid		A,B2R9X0.78
IFAA,B3FC80.72
MCG(S)-(ALPHA)-METHYL-4-CARBOXYPHENYLGLYCINEA,B1ISS0.76
4MP1-(4-METHOXYBENZOYL)-2-PYRROLIDINONEA,B2AL50.74
2013-AMIDO-5-BIPHENYL-BENZOIC ACIDA2B0M0.8
AG6N-[(benzyloxy)carbonyl]-L-alpha-
glutamyl-N-[(1S)-4-oxo-4-phenyl-
1-propylbut-2-en-1-yl]-L-phenylalaninamide		A3FRZ0.72
MN71-CARBOXY-4-ISOBUTYLAMINOMETHYLBENZENEN1NLO0.83
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B,C,D1SN90.74
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B1SNE0.74
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B,C,D1SNA0.74
DBZ3-(BENZOYLAMINO)-L-ALANINEA,B1XOF0.74
PAB4-AMINOBENZOIC ACIDA1PBD0.73
PAB4-AMINOBENZOIC ACIDB2DZA0.73
PAB4-AMINOBENZOIC ACIDA1IUS0.73
PAB4-AMINOBENZOIC ACIDA1IUU0.73
PAB4-AMINOBENZOIC ACIDA1IUT0.73
401(2S)-2-{3-[({[2-fluoro-4-(trifluoromethyl)phenyl]carbonyl}amino)methyl]-
4-methoxybenzyl}butanoic acid		A,B2ZNQ0.7
KAFN-{(5S)-4,4-dihydroxy-6-phenyl-
5-[(phenylcarbonyl)amino]hexanoyl}-
L-phenylalanine		A3BKK0.72
3FL3-{[(4-{[(2,6-dioxo-1,2,3,6-tetrahydropyrimidin-
4-yl)methyl]amino}butyl)amino]methyl}benzoic acid		A,B3FCL0.78
UBC(S)-1-(2-AMINO-2-CARBOXYETHYL)-
3-(2-CARBOXYBENZYL)PYRIMIDINE-2,4-
DIONE		A,B2F350.73
CIN4-CARBOXYCINNAMIC ACIDA,B,C,D1HAB0.73
CIN4-CARBOXYCINNAMIC ACIDA,B1T6J0.73
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY50.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY80.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY90.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XXZ0.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY40.71
IAM4-[(ISOPROPYLAMINO)METHYL]PHENYLALANINEA1XY60.71
4MA4-METHYLBENZOIC ACIDA,H2HRG0.74
LOBLOBELINEA,B,C,D,E,F,
G,H,I,J		2BYS0.72
3CBN-[(3-CARBOXYBENZYL)SULFONYL]ISOLEUCYL-
N~1~-{4-[AMINO(IMINO)METHYL]BENZYL}-
5-IMINOORNITHINAMIDE		H,L1WSS0.7
1974-[2-ACETYLAMINO-2-(1-BIPHENYL-
4-YLMETHYL-2-OXO-AZEPAN-3-YLCARBAMOYL)-
ETHYL]-2-FORMYL-BENZOIC ACID		A1O4A0.72
4CB4-CARBOXYPHENYLBORONIC ACIDA,B1KDW0.72
DHQ3,4-DIHYDRO-5-METHYL-ISOQUINOLINONEA1PAX0.71
NPGN-SUCCINYL PHENYLGLYCINEA,B,C,D1SJD0.73
ST34-(ACETYLAMINO)-3-AMINO BENZOIC ACIDA,B1IVE0.74
BJI1(R)-1-ACETAMIDO-2-(3-CARBOXYPHENYL)ETHYL BORONIC ACIDA1ERM0.86
DK22-[(1R)-1-CARBOXY-2-(4-HYDROXYPHENYL)ETHYL]-
1,3-DIOXOISOINDOLINE-5-CARBOXYLIC ACID		A,B2PU20.76
MBOMERCURIBENZOIC ACIDA2QO80.73
MBOMERCURIBENZOIC ACIDA1LUG0.73
MBOMERCURIBENZOIC ACIDA2HOC0.73
MBOMERCURIBENZOIC ACIDA3EFI0.73
MBOMERCURIBENZOIC ACIDA3BL00.73
MBOMERCURIBENZOIC ACIDA,B,C,D,E,F1NAQ0.73
MBOMERCURIBENZOIC ACIDA3CAJ0.73
MBOMERCURIBENZOIC ACIDA1DR70.73
MBOMERCURIBENZOIC ACIDA2HL40.73
MBOMERCURIBENZOIC ACIDA2GD80.73
MBOMERCURIBENZOIC ACIDA2QP60.73
MBOMERCURIBENZOIC ACIDA2HD60.73
MBOMERCURIBENZOIC ACIDA3C7P0.73
MBOMERCURIBENZOIC ACIDA,B2JHN0.73
MBOMERCURIBENZOIC ACIDA1DR60.73
MBOMERCURIBENZOIC ACIDA2HNC0.73
MBOMERCURIBENZOIC ACIDA2QOA0.73
SP9N-{(1R)-3-[(4-aminobutyl)amino]-
1-methylpropyl}benzamide		A,B3CNT0.7
072(+/-)(2S,5S)-3-(4-(4-CARBOXYPHENYL)BUTYL)-
2-HEPTYL-4-OXO-5-THIAZOLIDINE		A,B,C,D4PRG0.75
TYZPARA ACETAMIDO BENZOIC ACIDB,C2BNI0.79
TYZPARA ACETAMIDO BENZOIC ACIDA1W5K0.79
TYZPARA ACETAMIDO BENZOIC ACIDA1W5J0.79
8535-[2-ACETYLAMINO-2-(1-BIPHENYL-
4-YLMETHYL-2-OXO-AZEPAN-3-YLCARBAMOYL)-
ETHYL]-2-CARBOXYMETHYL-BENZOIC ACID		A1O480.77
SM2(1R)-1-(2-THIENYLACETYLAMINO)-1-
(3-CARBOXYPHENYL)METHYLBORONIC ACID		A,B1PI50.78
SM2(1R)-1-(2-THIENYLACETYLAMINO)-1-
(3-CARBOXYPHENYL)METHYLBORONIC ACID		A1NXY0.78
SM2(1R)-1-(2-THIENYLACETYLAMINO)-1-
(3-CARBOXYPHENYL)METHYLBORONIC ACID		A,B1MXO0.78
SM2(1R)-1-(2-THIENYLACETYLAMINO)-1-
(3-CARBOXYPHENYL)METHYLBORONIC ACID		A,B1YM10.78
ALRALRESTATINA1AZ10.73
3B42-(cyclohexylamino)benzoic acidA,B3B4P0.72
46C4-[(6-chloro-1-oxo-4-phenyl-3-propanoylisoquinolin-
2(1H)-yl)methyl]benzoic acid		A2ZDT0.71