ZINC 12

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Names
Compounds (1,840)
Reactome (0)
Related By:
Pathway (0)
Organism (0)
Gene (1)
Org. Clust. (3)
ChEMBL (55)
Rings (50)

Beta-secretase 1, Human (1,840 Compounds)

Swissprot:: BACE1_HUMAN
Stitch:: BACE1_HUMAN
UniProt:: P56817
ChEMBL:: CHEMBL4822
PDB:: 1FKN (DOCK); 1M4H (DOCK); 1PY1 (DOCK); 1SGZ (DOCK); 1TQF (DOCK); 1UJJ (DOCK); 1UJK (DOCK); 1W50 (DOCK); 1W51 (DOCK); 1XN2 (DOCK); 1XN3 (DOCK); 1XS7 (DOCK); 1YM2 (DOCK); 1YM4 (DOCK); 2B8L (DOCK); 2B8V (DOCK); 2F3E (DOCK); 2F3F (DOCK); 2FDP (DOCK); 2G94 (DOCK); 2HIZ (DOCK); 2HM1 (DOCK); 2IQG (DOCK); 2IRZ (DOCK); 2IS0 (DOCK); 2NTR (DOCK); 2OAH (DOCK); 2OF0 (DOCK); 2OHK (DOCK); 2OHL (DOCK); 2OHM (DOCK); 2OHN (DOCK); 2OHP (DOCK); 2OHQ (DOCK); 2OHR (DOCK); 2OHS (DOCK); 2OHT (DOCK); 2OHU (DOCK); 2P4J (DOCK); 2P83 (DOCK); 2P8H (DOCK); 2PH6 (DOCK); 2PH8 (DOCK); 2Q11 (DOCK); 2Q15 (DOCK); 2QK5 (DOCK); 2QMD (DOCK); 2QMF (DOCK); 2QMG (DOCK); 2QP8 (DOCK); 2QU2 (DOCK); 2QU3 (DOCK); 2QZK (DOCK); 2QZL (DOCK); 2VA5 (DOCK); 2VA6 (DOCK); 2VA7 (DOCK); 2VIE (DOCK); 2VIJ (DOCK); 2VIY (DOCK); 2VIZ (DOCK); 2VJ6 (DOCK); 2VJ7 (DOCK); 2VJ9 (DOCK); 2VKM (DOCK); 2VNM (DOCK); 2VNN (DOCK); 2WEZ (DOCK); 2WF0 (DOCK); 2WF1 (DOCK); 2WF2 (DOCK); 2WF3 (DOCK); 2WF4 (DOCK); 2WJO (DOCK); 2XFI (DOCK); 2XFJ (DOCK); 2XFK (DOCK); 2ZDZ (DOCK); 2ZE1 (DOCK); 2ZHR (DOCK); 2ZHS (DOCK); 2ZHT (DOCK); 2ZHU (DOCK); 2ZHV (DOCK); 2ZJH (DOCK); 2ZJI (DOCK); 2ZJJ (DOCK); 2ZJK (DOCK); 2ZJL (DOCK); 2ZJM (DOCK); 2ZJN (DOCK); 3BRA (DOCK); 3BUF (DOCK); 3BUG (DOCK); 3BUH (DOCK); 3CIB (DOCK); 3CIC (DOCK); 3CID (DOCK); 3CKP (DOCK); 3CKR (DOCK); 3DM6 (DOCK); 3DUY (DOCK); 3DV1 (DOCK); 3DV5 (DOCK); 3EXO (DOCK); 3FKT (DOCK); 3H0B (DOCK); 3HVG (DOCK); 3HW1 (DOCK); 3I25 (DOCK); 3IGB (DOCK); 3IN3 (DOCK); 3IN4 (DOCK); 3IND (DOCK); 3INE (DOCK); 3INF (DOCK); 3INH (DOCK); 3IVH (DOCK); 3IVI (DOCK); 3IXJ (DOCK); 3IXK (DOCK); 3K5C (DOCK); 3K5D (DOCK); 3K5F (DOCK); 3K5G (DOCK); 3KMX (DOCK); 3KMY (DOCK); 3KN0 (DOCK); 3KYR (DOCK); 3L38 (DOCK); 3L3A (DOCK); 3L58 (DOCK); 3L59 (DOCK); 3L5B (DOCK); 3L5C (DOCK); 3L5D (DOCK); 3L5E (DOCK); 3L5F (DOCK); 3LHG (DOCK); 3LNK (DOCK); 3LPI (DOCK); 3LPJ (DOCK); 3LPK (DOCK); 3MSJ (DOCK); 3MSK (DOCK); 3MSL (DOCK); 3N4L (DOCK); 3NSH (DOCK); 3OHF (DOCK); 3OHH (DOCK); 3OOZ (DOCK); 3PI5 (DOCK); 3QBH (DOCK); 3R1G (DOCK); 3R2F (DOCK); 3RSV (DOCK); 3RSX (DOCK); 3RTH (DOCK); 3RTM (DOCK); 3RTN (DOCK); 3RU1 (DOCK); 3RVI (DOCK); 3S2O (DOCK); 3S7L (DOCK); 3S7M (DOCK); 3SKF (DOCK); 3SKG (DOCK); 3TPJ (DOCK); 3TPL (DOCK); 3TPP (DOCK); 3TPR (DOCK); 3U6A (DOCK); 3UFL (DOCK); BACE1

Compound Summary

Annotation Type	Substances	Purchasable	Natural	In Man
Binding ≤ 10μM	1,840	25	21	11
Binding ≤ 1μM	1,394	5	3	4
Functional ≤ 10μM	32	1	0	0

UniProt	Swissprot	ChEMBL	Description	Substances	Purchasable	Natural	In Man
BACE2_HUMAN	Q9Y5Z0	CHEMBL2525	Beta Secretase 2, Human	484	0	0	0

Clustered By Gene (0)

Clustered By Organism (3)

Code	Description	Substances	Purchasable	Natural	In Man
BACE1-1-E	Beta-secretase 1 (cluster #1 Of 4), Eukaryotic	1,354	3	0	4
BACE1-2-E	Beta-secretase 1 (cluster #2 Of 4), Eukaryotic	532	22	19	8
BACE1-3-E	Beta-secretase 1 (cluster #3 Of 4), Eukaryotic	0	0	0	0
BACE1-4-E	Beta-secretase 1 (cluster #4 Of 4), Eukaryotic	3	0	2	0

Uniprot	Swissprot	Chembl	Description	Number Shared
BACE2_HUMAN	Q9Y5Z0	CHEMBL2525	Beta Secretase 2, Human	493
CATD_HUMAN	P07339	CHEMBL2581	Cathepsin D, Human	452
CATB_HUMAN	P07858	CHEMBL4072	Cathepsin B, Human	30
RENI_HUMAN	P00797	CHEMBL286	Renin, Human	23
A4_HUMAN	P05067	CHEMBL2487	Beta Amyloid A4 Protein, Human	16
ACES_HUMAN	P22303	CHEMBL220	Acetylcholinesterase, Human	13
Z80936	Z80936	CHEMBL614818	HEK293 (Embryonic Kidney Fibroblasts)	13
ACES_RAT	P37136	CHEMBL3199	Acetylcholinesterase, Rat	10
CATE_HUMAN	P14091	CHEMBL3092	Cathepsin E, Human	9
PEPA_HUMAN	P00790	CHEMBL3295	Pepsin A, Human	9
PEPC_HUMAN	P20142	CHEMBL2136	Pepsinogen C, Human	9
CHLE_HUMAN	P06276	CHEMBL1914	Butyrylcholinesterase, Human	5
KCNH2_HUMAN	Q12809	CHEMBL240	HERG, Human	4
PEN2_HUMAN	Q9NZ42	CHEMBL2374	Gamma-secretase Subunit PEN-2, Human	4
APH1A_HUMAN	Q96BI3	CHEMBL2362	Gamma-secretase Subunit APH-1A, Human	3
APH1B_HUMAN	Q8WW43	CHEMBL2385	Gamma-secretase Subunit APH-1B, Human	3
NICA_HUMAN	Q92542	CHEMBL3418	Nicastrin, Human	3
PSN1_HUMAN	P49768	CHEMBL2473	Presenilin 1, Human	3
PSN2_HUMAN	P49810	CHEMBL3708	Presenilin 2, Human	3
SC5A2_HUMAN	P31639	CHEMBL3884	Sodium/glucose Cotransporter 2, Human	3
ACES_BOVIN	P23795	CHEMBL4768	Acetylcholinesterase, Bovin	2
ESR1_HUMAN	P03372	CHEMBL206	Estrogen Receptor Alpha, Human	2
PGH1_HUMAN	P23219	CHEMBL221	Cyclooxygenase-1, Human	2
5HT1D_PIG	P79400	CHEMBL4105	Serotonin 1d (5-HT1d) Receptor, Pig	1
5HT2C_HUMAN	P28335	CHEMBL225	Serotonin 2c (5-HT2c) Receptor, Human	1
6PGD_HUMAN	P52209	CHEMBL3404	6-phosphogluconate Dehydrogenase, Human	1
ACES_ELEEL	O42275	CHEMBL4078	Acetylcholinesterase, Eleel	1
CHLE_HORSE	P81908	CHEMBL5763	Cholinesterase, Horse	1
DRD3_HUMAN	P35462	CHEMBL234	Dopamine D3 Receptor, Human	1
G6PD_YEAST	P11412	CHEMBL1075249	Glucose-6-phosphate 1-dehydrogenase, Yeast	1
GBRA1_HUMAN	P14867	CHEMBL1962	GABA Receptor Alpha-1 Subunit, Human	1
GBRA2_HUMAN	P47869	CHEMBL4956	GABA Receptor Alpha-2 Subunit, Human	1
GBRA3_HUMAN	P34903	CHEMBL3026	GABA Receptor Alpha-3 Subunit, Human	1
GBRA4_HUMAN	P48169	CHEMBL2472	GABA Receptor Alpha-4 Subunit, Human	1
GBRA5_HUMAN	P31644	CHEMBL5112	GABA Receptor Alpha-5 Subunit, Human	1
GBRA6_HUMAN	Q16445	CHEMBL2579	GABA Receptor Alpha-6 Subunit, Human	1
GBRB1_HUMAN	P18505	CHEMBL4558	GABA Receptor Beta-1 Subunit, Human	1
GBRB2_HUMAN	P47870	CHEMBL1920	GABA Receptor Beta-2 Subunit, Human	1
GBRB3_HUMAN	P28472	CHEMBL1847	GABA Receptor Beta-3 Subunit, Human	1
GBRD_HUMAN	O14764	CHEMBL3591	GABA Receptor Delta Subunit, Human	1
GBRE_HUMAN	P78334	CHEMBL4635	GABA Receptor Epsilon Subunit, Human	1
GBRG1_HUMAN	Q8N1C3	CHEMBL4044	GABA Receptor Gamma-1 Subunit, Human	1
GBRG2_HUMAN	P18507	CHEMBL1788	GABA Receptor Gamma-2 Subunit, Human	1
GBRG3_HUMAN	Q99928	CHEMBL2739	GABA Receptor Gamma-3 Subunit, Human	1
GBRP_HUMAN	O00591	CHEMBL3506	GABA Receptor Pi Subunit, Human	1
GBRT_HUMAN	Q9UN88	CHEMBL2843	GABA Receptor Theta Subunit, Human	1
OPRD_HUMAN	P41143	CHEMBL236	Delta Opioid Receptor, Human	1
OPRD_PIG	P79291	CHEMBL4103	Delta Opioid Receptor, Pig	1
Q965D5_PLAFA	Q965D5	CHEMBL4150	Enoyl-acyl-carrier Protein Reductase, Plafa	1
Q965D6_PLAFA	Q965D6	CHEMBL4513	3-oxoacyl-acyl-carrier Protein Reductase, Plafa	1
Q965D7_PLAFA	Q965D7	CHEMBL4512	Fatty Acid Synthase, Plafa	1
Q9JKC1_RAT	Q9JKC1	CHEMBL3403	Butyrylcholinesterase, Rat	1
Q9N1N9_HORSE	Q9N1N9	CHEMBL5077	Butyrylcholinesterase, Horse	1
Z104301	Z104301	CHEMBL1907607	GABA-A Receptor; Anion Channel	1
Z80331	Z80331	CHEMBL614062	N2a (Neuroblastoma Cells)	1