test molecule (Given Ligand) | CHEMBL2012250 (Similar Ligand) |
---|---|
COc1ncnc(OC)c1C(=O)Nc3nc(C(F)(F)F)c(c2ccccc2)s3 | CC1(C)C(=O)N(Cc2ccccc2)c2ncnc(OC3CCN(Cc4cscn4)CC3)c21 |
10034043 01000019 2018098c 00010610 81000000 10024508 4040c580 18129409 00000900 a0000873 48302a04 50008600 08008008 00210001 21022803 801c200c 00820000 0200408c 04400010 c0a60000 84020001 08082e80 60a00c40 10414828 02041081 cc082980 00220a00 b0000744 0000430c 044e2001 c4005000 8c210380 | 0403c002 81800018 2010090c 09090e10 b0000002 86114040 0000a000 2a10ba09 80410380 800908c0 203d0a24 5001d080 06008802 08100001 01022500 001c200c 90248080 2200c08a 00c00010 4024a201 80120400 18259680 218140c0 90550018 00041001 cc008e80 00220010 90001084 0408030c 04460001 e0047000 282303c1 |