Compound 2
Smiles:
OCC(=O)[C@@]1(O)[C@H](C)C[C@@H]2[C@]1(C)C[C@H](O)[C@]1([C@H]2CCC2=CC(=O)C=C[C@]12C)F
Current docking status:
Idle
Top 100 Predicted Targets
| Gene |
Pdb |
Chain |
Pocket |
Score |
| ALB |
1N5U |
A |
1 |
-11.98615 |
| PLCB3 |
4GNK |
B |
0 |
-11.849969999999999 |
| PARP1 |
1UK0 |
A |
0 |
-11.321010000000001 |
| RAMP1 |
4RWG |
B |
0 |
-11.30747 |
| DDAH1 |
2JAJ |
B |
0 |
-11.22974 |
| C5 |
4A5W |
A |
1 |
-11.16878 |
| ITGA4 |
4IRZ |
A |
0 |
-11.11897 |
| PRKCA |
3IW4 |
C |
0 |
-10.99253 |
| ALDH5A1 |
2W8N |
A |
0 |
-10.96279 |
| AKT1 |
4EJN |
A |
0 |
-10.930660000000001 |
| ITGAV |
4G1E |
A |
0 |
-10.85297 |
| DCPS |
1ST0 |
A |
0 |
-10.838519999999999 |
| LYN |
3A4O |
X |
0 |
-10.8255 |
| TOP2A |
1ZXM |
B |
1 |
-10.78795 |
| ABL1 |
2F4J |
A |
0 |
-10.78092 |
| POLG |
3IKM |
D |
3 |
-10.75464 |
| ABL1 |
2FO0 |
A |
0 |
-10.73197 |
| NAMPT |
4KFN |
A |
0 |
-10.727780000000001 |
| CBR1 |
1WMA |
A |
0 |
-10.7209 |
| PARP2 |
3KCZ |
A |
0 |
-10.656139999999999 |
| DHRS4 |
3O4R |
A |
0 |
-10.63383 |
| PARP1 |
4ZZZ |
A |
0 |
-10.63297 |
| IMPDH1 |
1JCN |
A |
0 |
-10.61477 |
| XPNPEP1 |
3CTZ |
A |
0 |
-10.6091 |
| PRPF4B |
4IIR |
B |
0 |
-10.608789999999999 |
| TKT |
4KXV |
A |
1 |
-10.57217 |
| KDM4C |
4XDO |
A |
0 |
-10.56286 |
| ITGAV |
3IJE |
A |
0 |
-10.48168 |
| FURIN |
4OMC |
A |
1 |
-10.46247 |
| AIM2 |
3VD8 |
A |
0 |
-10.41047 |
| CANT1 |
1S18 |
A |
0 |
-10.38803 |
| BPHL |
2OCG |
A |
0 |
-10.38241 |
| NEK2 |
2W5A |
A |
0 |
-10.377930000000001 |
| TOP1 |
1SEU |
A |
0 |
-10.36583 |
| SERPINA5 |
3DY0 |
A |
0 |
-10.351339999999999 |
| NMT1 |
3IU1 |
B |
0 |
-10.341339999999999 |
| KEAP1 |
1U6D |
X |
0 |
-10.330919999999999 |
| CRAT |
1NM8 |
A |
0 |
-10.31962 |
| RORC |
4YMQ |
A |
0 |
-10.31798 |
| WDR61 |
3OW8 |
C |
0 |
-10.30889 |
| TOP2A |
1ZXM |
B |
0 |
-10.30223 |
| NT5C2 |
2XCW |
A |
1 |
-10.291080000000001 |
| DNMT1 |
3SWR |
A |
1 |
-10.28533 |
| JMJD6 |
3K2O |
B |
0 |
-10.25698 |
| SUPV3L1 |
3RC8 |
A |
0 |
-10.25307 |
| IDE |
2G49 |
A |
0 |
-10.24296 |
| HSD17B4 |
1IKT |
A |
0 |
-10.23949 |
| VDR |
1IE9 |
A |
0 |
-10.23826 |
| ACAD8 |
1RX0 |
A |
0 |
-10.22945 |
| GMDS |
1T2A |
A |
0 |
-10.21671 |
| STK10 |
5AJQ |
A |
0 |
-10.192919999999999 |
| RBBP7 |
3CFV |
B |
0 |
-10.18078 |
| NR3C1 |
4P6W |
A |
0 |
-10.15457 |
| LTA4H |
1HS6 |
A |
0 |
-10.14328 |
| TOP2A |
1ZXN |
C |
0 |
-10.1288 |
| AIFM1 |
4LII |
A |
0 |
-10.124080000000001 |
| ALDH1A1 |
4WP7 |
A |
0 |
-10.10189 |
| HMGCL |
2CW6 |
A |
0 |
-10.08649 |
| RRAGD |
2Q3F |
A |
0 |
-10.08513 |
| MAPK14 |
1YQJ |
A |
1 |
-10.07341 |
| TOPBP1 |
3UEN |
A |
0 |
-10.061589999999999 |
| RAE1 |
3MMY |
C |
0 |
-10.06129 |
| AGTR1 |
4YAY |
A |
0 |
-10.0608 |
| LCK |
3MPM |
A |
0 |
-10.06005 |
| WARS |
1R6T |
A |
0 |
-10.0458 |
| PRKCB |
2I0E |
A |
0 |
-10.035110000000001 |
| PLA2G4A |
1CJY |
A |
0 |
-10.023639999999999 |
| GSR |
3DJJ |
A |
0 |
-9.997689999999999 |
| MUT |
2XIQ |
A |
0 |
-9.98387 |
| VDR |
3AZ3 |
A |
0 |
-9.9734 |
| NR1H2 |
4NQA |
B |
0 |
-9.96353 |
| PRKACA |
4WB7 |
A |
1 |
-9.9584 |
| PIK3CA |
4OVU |
A |
0 |
-9.94996 |
| SULT2B1 |
1Q20 |
A |
0 |
-9.94407 |
| HMGCS1 |
2P8U |
A |
0 |
-9.93902 |
| PIK3R1 |
4YKN |
A |
0 |
-9.93711 |
| IMPDH2 |
1NF7 |
A |
0 |
-9.92923 |
| ODC1 |
2OO0 |
A |
0 |
-9.92101 |
| BRAF |
4MNE |
B |
0 |
-9.91275 |
| PITPNA |
1UW5 |
A |
0 |
-9.88866 |
| SLC2A1 |
4PYP |
A |
0 |
-9.88144 |
| PARP1 |
4DQY |
C |
0 |
-9.86984 |
| CFB |
2OK5 |
A |
0 |
-9.86461 |
| C5 |
4A5W |
A |
0 |
-9.86258 |
| LDLR |
1IJQ |
A |
0 |
-9.83825 |
| PRKAG1 |
4REW |
G |
0 |
-9.8377 |
| TLR2 |
2Z7X |
A |
0 |
-9.825460000000001 |
| PIM2 |
2IWI |
B |
0 |
-9.8196 |
| BACE2 |
3ZKQ |
A |
0 |
-9.81743 |
| EPHA2 |
3HEI |
A |
0 |
-9.81432 |
| ESR1 |
2IOK |
B |
0 |
-9.81381 |
| TBK1 |
4IW0 |
A |
0 |
-9.80467 |
| IFIT5 |
4HOR |
A |
0 |
-9.79294 |
| PIK3CA |
3ZIM |
A |
1 |
-9.79169 |
| GGT1 |
4GDX |
B |
0 |
-9.79149 |
| LDLR |
1N7D |
A |
1 |
-9.7912 |
| NR5A2 |
4RWV |
A |
0 |
-9.78655 |
| DNMT1 |
3SWR |
A |
0 |
-9.77637 |
| AMD1 |
1MSV |
B |
0 |
-9.75736 |
| PDE4D |
3G4I |
D |
0 |
-9.74434 |
DrugQuery