Contact Proteins for Similar Compounds


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threshold chemical similarty
(tanimoto coefficient)
[0.5] [0.6] [0.7] [0.8] [0.9] [1.0] max number of compounds [1] [5] [10] [20] [30] [40] [50]

Chosen similar compounds

compound similarity compound similarity compound similarity compound similarity compound similarity
query [D00429]
[2D] [3D]
*** ROC1.000 0PO0.772 RO10.737 KNI0.610
1UN0.589 0DO0.583 RSZ0.576 PI40.571 V3D0.525
NYF0.508 0AX0.500 89K0.500 GGX0.493 06Q0.492
49W0.492 89B0.492 8O50.492 K950.485 M910.484
VAC0.484

Proteins contacting with similar compounds to the query

Nrank Protein Nresidue pdb_id+asym_id
1 PEPA_PIG Pepsin A 326 [ROC]:6xcz_A_B
2 Q000H7_9HIV1 Multidrug-resistant clinical isolate 769 HIV-1 Protease 99 [RSZ]:3r0y_A_C [RSZ]:3r0y_B_C
3 O09893_9HIV1 PROTEIN (PROTEASE) 99 [ROC]:1c6z_A_C [ROC]:1c6z_B_C
4 CATL1_HUMAN Procathepsin L 220 [89K]:7w34_A_B [89B]:7w33_A_B
5 CAN1_HUMAN Calpain-1 catalytic subunit 322 [89K]:7x79_A_B [06Q]:7w7o_A_B
6 CARP_CRYPA Endothiapepsin 330 [ROC]:3pww_A_B [M91]:1e81_A_B
7 CP3A4_HUMAN Cytochrome P450 3A4 455 [NYF]:7uff_A_E [NYF]:7uff_B_G
8 POL_HV1BR HIV-1 protease 99 [ROC]:3ufn_A_C [ROC]:3ufn_A_D [ROC]:3ufn_B_C [ROC]:3ufn_B_D
9 Q50CM2_9HIV1 Protease 99 [1UN]:2r5q_A_E [1UN]:2r5q_B_E [1UN]:2r5q_C_F [1UN]:2r5q_D_F
10 POL_HV2RO Protease 99 [0PO]:1ida_A_C [0PO]:1ida_B_C [0DO]:1idb_A_C [0DO]:1idb_B_C
11 POL_HV1H2 Protease 198 [ROC]:3n3i_A_B [ROC]:4q5m_A_B [ROC]:7dt9_A_B [1UN]:7doz_A_B
12 PLM2_PLAFA Plasmepsin-2 329 [49W]:4ya8_A_E [49W]:4ya8_B_F [49W]:4ya8_C_H [49W]:4ya8_D_K [K95]:5yid_A_B
13 Q9Y006_PLAFA Histo-aspartic protease 323 [K95]:3qvi_A_E [K95]:3qvi_B_E [K95]:3qvi_C_O [K95]:3qvi_C_P [K95]:3qvi_D_O [K95]:3qvi_D_P
14 R1A_CVHSA 3C-like proteinase 301 [V3D]:6xhn_A_C [V3D]:6xhn_B_E [0AX]:8gxh_A_B [0AX]:8gxh_A_B [8O5]:5n5o_A_B [8O5]:5n5o_A_B [06Q]:8gxg_A_B [06Q]:8gxg_A_B
15 Q72874_9HIV1 HIV-1 PROTEASE 99 [ROC]:1fb7_A_B [ROC]:1fb7_A_B [ROC]:1fb7_A_B [ROC]:1fb7_A_B [ROC]:1hxb_A_C [ROC]:1hxb_B_C [ROC]:2nmy_A_F [ROC]:2nmy_B_F [ROC]:2nmz_A_F [ROC]:2nmz_B_F [ROC]:2nnk_A_E [ROC]:2nnk_B_E [ROC]:2nnp_A_C [ROC]:2nnp_B_C [ROC]:3cyx_A_C [ROC]:3cyx_B_C [ROC]:3d1x_A_D [ROC]:3d1x_B_D [ROC]:3d1y_A_E [ROC]:3d1y_B_E [ROC]:3ekq_A_C [ROC]:3ekq_B_C [ROC]:3el4_A_C [ROC]:3el4_B_C [ROC]:3k4v_A_G [ROC]:3k4v_B_G [ROC]:3k4v_C_J [ROC]:3k4v_D_J [ROC]:3ndt_A_E [ROC]:3ndt_B_E [ROC]:3ndt_C_S [ROC]:3ndt_D_S [ROC]:3ndu_A_E [ROC]:3ndu_B_E [ROC]:3ndu_C_Z [ROC]:3ndu_D_Z [ROC]:3oxc_A_C [ROC]:3oxc_B_C [ROC]:3pwr_A_C [ROC]:3pwr_B_C [ROC]:3s56_A_C [ROC]:3s56_B_C [ROC]:3s56_B_D [ROC]:3tkg_A_G [ROC]:3tkg_B_G [ROC]:3tkg_C_I [ROC]:3tkg_D_I [ROC]:3tl9_A_C [ROC]:3tl9_B_C [ROC]:4qgi_A_C [ROC]:4qgi_B_C [ROC]:5kqx_A_C [ROC]:5kqx_B_C [ROC]:5kr2_A_E [ROC]:5kr2_B_E [ROC]:5kr2_C_F [ROC]:5kr2_D_F [RO1]:2f3k_A_F [RO1]:2f3k_B_F [KNI]:1hpx_A_C [KNI]:1hpx_B_C [KNI]:2zye_A_C [KNI]:2zye_B_C [KNI]:3fx5_A_D [KNI]:3fx5_B_D [1UN]:1ohr_A_C [1UN]:1ohr_B_C [1UN]:2pym_A_C [1UN]:2pym_B_C [1UN]:2pyn_A_C [1UN]:2pyn_B_C [1UN]:2q63_A_C [1UN]:2q63_B_C [1UN]:2q64_A_C [1UN]:2q64_B_C [1UN]:2qak_A_C [1UN]:2qak_B_C [1UN]:3ekx_A_C [1UN]:3ekx_B_C [1UN]:3el0_A_C [1UN]:3el0_B_C [1UN]:3el5_A_I [1UN]:3el5_B_I [PI4]:1b6l_A_E [PI4]:1b6l_B_E [GGX]:3ggx_A_I [GGX]:3ggx_B_I [GGX]:3ggx_C_J [GGX]:3ggx_D_J [GGX]:3ggx_E_K [GGX]:3ggx_F_K [GGX]:3ggx_G_L [GGX]:3ggx_H_L [VAC]:4phv_A_C [VAC]:4phv_A_D [VAC]:4phv_B_C [VAC]:4phv_B_D