Compound 30
Smiles:
OCCN1CCN(CC1)c1cc(nc(n1)C)Nc1ncc(s1)C(=O)Nc1c(C)cccc1Cl
Current docking status:
Idle
Top 100 Predicted Targets
| Gene |
Pdb |
Chain |
Pocket |
Score |
| TOP1 |
1RR8 |
C |
0 |
-12.032 |
| DHRS4 |
3O4R |
A |
0 |
-11.75799 |
| CYP1A1 |
4I8V |
A |
0 |
-11.52702 |
| WARS |
1R6T |
A |
0 |
-11.091280000000001 |
| KDM1A |
2IW5 |
A |
0 |
-11.033380000000001 |
| AKT1 |
4EJN |
A |
0 |
-10.89222 |
| TYK2 |
4PO6 |
A |
0 |
-10.837480000000001 |
| GNAI1 |
3UMS |
A |
1 |
-10.8217 |
| AKR1C2 |
1XJB |
A |
0 |
-10.80034 |
| GMDS |
1T2A |
A |
0 |
-10.76803 |
| PARP2 |
3KCZ |
A |
0 |
-10.752989999999999 |
| TOP1 |
1SEU |
A |
0 |
-10.752 |
| LDLR |
1IJQ |
A |
0 |
-10.72524 |
| KEAP1 |
3VNG |
A |
0 |
-10.71218 |
| ITGA4 |
4IRZ |
A |
0 |
-10.654580000000001 |
| CDK1 |
4Y72 |
A |
0 |
-10.64879 |
| DNMT1 |
3SWR |
A |
0 |
-10.62091 |
| ETFB |
1EFV |
B |
0 |
-10.5815 |
| NOS3 |
3EAH |
B |
0 |
-10.56135 |
| MGLL |
3PE6 |
A |
0 |
-10.5253 |
| CSNK2A1 |
3AT2 |
A |
0 |
-10.50501 |
| SERPINA5 |
3DY0 |
A |
0 |
-10.47514 |
| AKR1B1 |
3RX2 |
A |
0 |
-10.47172 |
| GGT1 |
4GDX |
B |
0 |
-10.471219999999999 |
| AIFM1 |
4LII |
A |
0 |
-10.46761 |
| MAPK8 |
4QTD |
A |
0 |
-10.446589999999999 |
| KDM4C |
4XDO |
A |
0 |
-10.424389999999999 |
| ITGAV |
4G1E |
A |
0 |
-10.41637 |
| NMT1 |
3IU1 |
B |
0 |
-10.40598 |
| ADRB2 |
4GBR |
A |
0 |
-10.39485 |
| ITGAV |
3IJE |
A |
0 |
-10.38838 |
| WARS |
1R6U |
A |
0 |
-10.37627 |
| NAA50 |
2OB0 |
C |
0 |
-10.36771 |
| SPR |
1Z6Z |
A |
0 |
-10.36412 |
| GNE |
2YHW |
A |
0 |
-10.35466 |
| VDR |
1IE9 |
A |
0 |
-10.35305 |
| KARS |
3BJU |
A |
0 |
-10.31269 |
| RRM1 |
3HNC |
B |
0 |
-10.30391 |
| HINT1 |
3TW2 |
A |
0 |
-10.29603 |
| MUT |
2XIQ |
A |
0 |
-10.282580000000001 |
| TLE1 |
1GXR |
A |
0 |
-10.281460000000001 |
| NR1H3 |
3IPU |
A |
0 |
-10.27568 |
| AHCY |
1A7A |
A |
0 |
-10.26732 |
| SERPINB2 |
2ARQ |
A |
0 |
-10.26047 |
| EGFR |
3W32 |
A |
0 |
-10.24827 |
| TH |
2XSN |
D |
0 |
-10.23975 |
| NNMT |
2IIP |
A |
0 |
-10.22516 |
| MAT2B |
2YDX |
A |
0 |
-10.2172 |
| ACVR1 |
4C02 |
A |
0 |
-10.21542 |
| DCPS |
1ST0 |
A |
0 |
-10.21263 |
| VDR |
3AZ3 |
A |
0 |
-10.21199 |
| PITPNA |
1UW5 |
A |
0 |
-10.1887 |
| CDK7 |
1UA2 |
A |
0 |
-10.16385 |
| PKN2 |
4CRS |
A |
0 |
-10.154910000000001 |
| YARS |
1N3L |
A |
0 |
-10.15124 |
| B2M |
4IIQ |
C |
1 |
-10.15012 |
| EIF2AK3 |
4X7K |
A |
0 |
-10.14782 |
| PCSK9 |
2P4E |
A |
0 |
-10.14338 |
| CLK1 |
1Z57 |
A |
0 |
-10.13468 |
| DDAH1 |
2JAJ |
B |
0 |
-10.12354 |
| HSD17B4 |
1ZBQ |
A |
0 |
-10.122060000000001 |
| CHEK2 |
2YCF |
A |
1 |
-10.1173 |
| DCXR |
1PR9 |
A |
0 |
-10.11513 |
| IDE |
3CWW |
A |
0 |
-10.11474 |
| ERBB2 |
2A91 |
A |
0 |
-10.11013 |
| RORC |
4YMQ |
A |
0 |
-10.10598 |
| HPGD |
2GDZ |
A |
0 |
-10.102319999999999 |
| GGPS1 |
2Q80 |
A |
0 |
-10.098310000000001 |
| PAH |
2PAH |
A |
0 |
-10.080210000000001 |
| PLA2G15 |
4X90 |
A |
0 |
-10.073789999999999 |
| ROCK2 |
4WOT |
B |
0 |
-10.0667 |
| BLM |
4CGZ |
A |
0 |
-10.06362 |
| GSR |
3DJJ |
A |
0 |
-10.057360000000001 |
| HSPA2 |
3I33 |
A |
0 |
-10.032810000000001 |
| FGFR3 |
4K33 |
A |
0 |
-10.0245 |
| CDK2 |
4GCJ |
A |
0 |
-10.02019 |
| NOS3 |
4D1O |
A |
0 |
-10.01865 |
| MAPK3 |
4QTB |
A |
0 |
-10.00929 |
| PC |
3BG3 |
D |
0 |
-10.00714 |
| PARP1 |
1UK0 |
A |
0 |
-9.99708 |
| TYK2 |
4WOV |
A |
0 |
-9.996410000000001 |
| WDR61 |
3OW8 |
C |
0 |
-9.98772 |
| NEK2 |
2W5A |
A |
0 |
-9.98213 |
| NPC1 |
3GKH |
A |
0 |
-9.98047 |
| SLC2A1 |
4PYP |
A |
0 |
-9.977260000000001 |
| PDPK1 |
4RQV |
A |
0 |
-9.96123 |
| AKT2 |
3D0E |
A |
0 |
-9.949819999999999 |
| IL1R2 |
3O4O |
C |
1 |
-9.9492 |
| CTBP2 |
2OME |
A |
0 |
-9.9445 |
| EP300 |
4PZS |
A |
0 |
-9.92949 |
| NMRAL1 |
2WM3 |
A |
0 |
-9.92862 |
| ASS1 |
2NZ2 |
A |
0 |
-9.92763 |
| PIK3CG |
1HE8 |
A |
0 |
-9.92706 |
| ME2 |
1GZ3 |
A |
0 |
-9.91884 |
| JAK1 |
4E5W |
A |
0 |
-9.91071 |
| NR1H2 |
4NQA |
I |
0 |
-9.907010000000001 |
| ADRB2 |
3PDS |
A |
0 |
-9.89888 |
| ALB |
1N5U |
A |
1 |
-9.89798 |
| PCSK9 |
2P4E |
A |
1 |
-9.89483 |
| CAT |
1DGH |
C |
1 |
-9.8932 |
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