Compound 27


Smiles:

CN[C@H]([C@H](c1ccccc1)O)C

Current docking status:

Idle

Top 100 Predicted Targets

(takes longer)

Gene Pdb Chain Pocket Score
LTA4H 1HS6 A 0 -7.930339999999999
HPRT1 1BZY A 0 -7.81235
AP1B1 4HMY B 4 -7.798310000000001
KDM4C 4XDO A 0 -7.7652600000000005
KDM5B 5A3N A 0 -7.759539999999999
FKBP4 4LAW B 0 -7.739089999999999
NT5C2 2XCW A 1 -7.70367
CYP1A1 4I8V A 0 -7.6322600000000005
PAH 1MMK A 0 -7.6140300000000005
FFAR1 4PHU A 1 -7.592389999999999
HRH1 3RZE A 0 -7.591
PARP10 3HKV A 0 -7.58472
LIG3 3L2P A 0 -7.566330000000001
EGLN1 4UWD A 0 -7.53919
NEDD4 4BBN A 1 -7.53723
GUSB 3HN3 B 1 -7.53293
MMP2 3AYU A 0 -7.524780000000001
NR1H3 3IPQ A 0 -7.51745
SFN 3SMN A 0 -7.4845
MGLL 3PE6 A 0 -7.4744
TGFBR1 2WOT A 2 -7.464639999999999
HINT1 3TW2 A 0 -7.46254
C5 3PVM A 0 -7.43553
NR1H2 4NQA I 0 -7.43253
NNMT 2IIP A 0 -7.422789999999999
MMP2 1GXD A 0 -7.36287
CAT 1DGH C 0 -7.362439999999999
POLG 3IKM D 1 -7.3505
KDM4B 4LXL A 0 -7.3376
MMP2 1CK7 A 0 -7.32955
AKR1B1 3RX2 A 0 -7.329
POLG2 3IKM C 0 -7.3289
SMYD3 3PDN A 0 -7.3274300000000006
PROCR 1LQV B 0 -7.32395
SULT2B1 1Q20 A 0 -7.32333
MSH2 3THW A 3 -7.32295
KARS 3BJU A 0 -7.310560000000001
NEK2 2W5A A 3 -7.30859
GYG1 3T7M A 0 -7.30766
TGFBR1 3HMM A 1 -7.294810000000001
GABBR1 4MS4 A 0 -7.292269999999999
PDK2 4MP7 A 3 -7.285189999999999
CA12 4HT2 A 0 -7.26293
PDK1 2Q8G A 1 -7.238989999999999
GGCT 3CRY A 0 -7.23705
ALB 1N5U A 4 -7.224469999999999
NT5E 4H2I A 0 -7.2072199999999995
LDLR 1N7D A 0 -7.193630000000001
TIMP3 3CKI B 0 -7.16655
B2M 4IIQ C 1 -7.16525
FGG 3GHG I 0 -7.16075
IDE 2G49 A 1 -7.13307
ADCK3 4PED A 0 -7.1317699999999995
DLD 1ZMC D 0 -7.11879
UCK2 1UJ2 A 0 -7.11769
IKBKB 4KIK B 4 -7.114669999999999
TNKS2 4HYF A 0 -7.11182
NT5E 4H1Y P 0 -7.103280000000001
CAT 1DGH C 1 -7.09185
CCND3 3G33 B 0 -7.08695
CSNK2A2 3OFM A 0 -7.086810000000001
NR1H2 4NQA B 0 -7.0737
HMGCS2 2WYA A 0 -7.069560000000001
WEE1 1X8B A 0 -7.04505
AR 1T65 A 0 -7.044410000000001
LYPLA1 1FJ2 A 3 -7.040660000000001
VDAC1 2JK4 A 1 -7.034789999999999
VRK2 2V62 B 0 -7.0288699999999995
PDPK1 3QC4 B 0 -7.02313
MAP3K8 4Y85 A 0 -7.013
ALDH7A1 4ZUK A 0 -7.010439999999999
IDE 3CWW A 1 -7.0061
SULT1A3 2A3R A 0 -7.002460000000001
NOS3 3EAH B 0 -7.0016300000000005
GNPDA1 1NE7 A 0 -7.001469999999999
SERPINB2 2ARQ A 0 -6.9943100000000005
RARB 4DM6 A 0 -6.993460000000001
VDR 3AZ3 A 0 -6.9931
LCMT1 3IEI A 0 -6.99035
MUT 2XIQ A 0 -6.9786399999999995
AMD1 1MSV B 1 -6.97582
CHKB 2IG7 B 0 -6.970910000000001
SIRT1 4KXQ A 0 -6.96813
FGFR1 4WUN A 0 -6.958089999999999
CLK1 1Z57 A 0 -6.950880000000001
TRAPPC3 1SZ7 A 0 -6.95051
SERPINA5 3DY0 A 0 -6.95023
NOS3 4D1O A 0 -6.94791
APOM 2WEW A 0 -6.946219999999999
LCN2 4GH7 A 0 -6.93726
TOP2A 4FM9 A 2 -6.935060000000001
HDAC8 3MZ4 B 0 -6.929180000000001
SERPINA5 3DY0 A 1 -6.91465
CAMKK2 2ZV2 A 0 -6.90349
DCK 1P60 A 0 -6.90142
CTLA4 2X44 D 0 -6.8978399999999995
CXCR4 3ODU A 0 -6.8906600000000005
SARS 4L87 A 0 -6.888539999999999
ERBB2 3PP0 B 0 -6.887580000000001
KDM1A 2IW5 A 2 -6.88225