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P20618 | PSB1_HUMAN | Proteasome subunit beta type-1 (PSMB1)

3D structures mapped by conservation among orthologs

[ Domain: "Proteasome subunits" // Proteasome ]

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[ Alpha Fold Model ] (go)


Known binders annotated in ChEMBL

IC50 table Ki table

molecule_chembl_id structure assay_type relation values units mol_wt smiles organism assay_chembl_id bao_label
CHEMBL1813256 OBDepict CH 3 CH 3 B HN H O O O O N H O HO O OH O Cl Cl IC50 = 10.64 nM 517.13 CC(C)C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccc1Cl)B1OC(=O)CC(CC(=O)O)(C(=O)O)O1 Homo sapiens CHEMBL4233072 single protein format
CHEMBL4248209 OBDepict CH 3 O N H H N H O O B H O O Cl CH 3 H 3 C Cl N H IC50 = 12.98 nM 474.19 COC[C@H](NC(=O)c1cc(Cl)ccc1Cl)C(=O)N[C@@H](CC(C)C)B1OCCNCCO1 Homo sapiens CHEMBL4233072 single protein format
CHEMBL4089402 OBDepict H 3 C CH 3 B N H H HO OH O HN H N O IC50 = 20.0 nM 437.35 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCc2ccccc2C1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4068221 OBDepict H 3 C CH 3 B N H H HO OH O HN H N O CH 3 IC50 = 30.0 nM 425.34 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N(C)Cc1ccccc1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL2141296 OBDepict OH B HO NH H O H 3 C H 3 C HN O Cl Cl IC50 = 31.0 nM 361.03 CC(C)C[C@H](NC(=O)CNC(=O)c1cc(Cl)ccc1Cl)B(O)O Homo sapiens CHEMBL2184802 single protein format
CHEMBL270515 OBDepict OH B HO NH H O H 3 C H 3 C NH H HO CH 3 H O N IC50 = 31.0 nM 413.28 CC(C)C[C@H](NC(=O)[C@@H](NC(=O)c1cccc(-c2ccccc2)n1)[C@@H](C)O)B(O)O Homo sapiens CHEMBL4403371 single protein format
CHEMBL4749207 OBDepict CH 3 CH 3 B HN H HO HO O N H H O OH IC50 = 52.0 nM 412.3 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)Cc1ccc(O)cc1)B(O)O Homo sapiens CHEMBL4682115 single protein format
CHEMBL325041 OBDepict H 3 C CH 3 B NH H OH OH O N H H O N N IC50 = 53.0 nM 384.25 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)c1cnccn1)B(O)O Homo sapiens CHEMBL2184802 single protein format
CHEMBL4080306 OBDepict H 3 C CH 3 B NH H OH OH O HN H N H O H 3 C H IC50 = 70.0 nM 425.34 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N[C@H](C)c1ccccc1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4096371 OBDepict CH 3 H 3 C B HN H HO OH O N H H N H O O IC50 = 80.0 nM 401.27 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccco1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4100727 OBDepict CH 3 CH 3 B HN H HO HO O NH H N H O F F IC50 = 110.0 nM 447.29 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc(F)c(F)c1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4075225 OBDepict CH 3 CH 3 B HN H HO HO O NH H N H O IC50 = 120.0 nM 461.37 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1ccc2ccccc2c1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL64925 OBDepict O N H H O CH 3 H 3 C HN H O CH 3 CH 3 N H H O O H 3 C CH 3 Ki = 130.0 nM 475.63 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL4185011 single protein format
CHEMBL4077037 OBDepict H 3 C CH 3 B N H H HO OH O N H H NH O H 3 C CH 3 IC50 = 130.0 nM 439.37 Cc1cccc(CNC(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@@H](CC(C)C)B(O)O)c1C Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4076838 OBDepict H 3 C CH 3 B NH H OH OH O HN H N H O + N O _ O IC50 = 140.0 nM 456.31 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1cccc([N+](=O)[O-])c1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4646371 OBDepict CH 3 H 3 C N H H O CH 3 O O N H H O H N O N H O H 3 C IC50 = 206.7 nM 514.62 CC(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1 Homo sapiens CHEMBL4605212 single protein format
CHEMBL289277 OBDepict CH 3 OH O O OH HO IC50 = 240.0 nM 270.24 Cc1cc(O)c2c(c1)C(=O)c1cc(O)cc(O)c1C2=O Homo sapiens CHEMBL4433377 single protein format
CHEMBL4070336 OBDepict H 3 C CH 3 B N H H OH HO O HN H NH O IC50 = 240.0 nM 487.41 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1cccc(-c2ccccc2)c1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4077282 OBDepict H 3 C H 3 C B NH H OH OH O N H H N H O IC50 = 240.0 nM 425.34 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCCc1ccccc1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL3287940 OBDepict H 3 C CH 3 B NH H HO OH O N O Ki = 240.0 nM 330.19 CC(C)C[C@H](NC(=O)CCn1ccc2ccccc2c1=O)B(O)O Homo sapiens CHEMBL3296842 cell-based format
CHEMBL4075298 OBDepict H 3 C CH 3 B NH H OH OH O HN H N H O H 3 C H IC50 = 280.0 nM 425.34 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N[C@@H](C)c1ccccc1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL207990 OBDepict H 3 C H 3 C H NH H HN O O H N H HO CH 3 H N H O CH 3 H CH 3 H 3 C O CH 3 H O CH 3 O CH 3 H 3 C IC50 = 300.0 nM 554.73 CC[C@H](C)[C@H](NC(=O)[C@H]([C@@H](C)CC)N(C)C(C)=O)C(=O)N[C@H](C(=O)N[C@@H](CC(C)C)C(=O)[C@@]1(C)CO1)[C@@H](C)O Homo sapiens CHEMBL2345511 cell-based format
CHEMBL3287943 OBDepict HO B HO HN H O CH 3 H 3 C N O Br Ki = 310.0 nM 395.06 CC(C)C[C@H](NC(=O)Cn1ccc2ccc(Br)cc2c1=O)B(O)O Homo sapiens CHEMBL3296842 cell-based format
CHEMBL4781914 OBDepict H 3 C CH 3 B N H H HO OH O HN CH 3 H O H N O H 3 C IC50 = 320.0 nM 341.22 CC(=O)N1CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)B(O)O Homo sapiens CHEMBL4682115 single protein format
CHEMBL3099618 OBDepict CH 3 O O N N Ki = 340.0 nM 566.83 CCC(=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1)c1ccccc1 Homo sapiens CHEMBL3100299 single protein format
CHEMBL3099624 OBDepict N O O N IC50 = 370.0 nM 538.78 C(=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1)c1ccccc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL4297468 OBDepict CH 3 O HO H NH H NH O O H N H CH 3 H O CH 3 O O N O IC50 = 430.0 nM 586.69 COc1ccc([C@@H](O)[C@H](NC(=O)[C@H](C)NC(=O)CN2CCOCC2)C(=O)N[C@@H](CC2=CCCC2)C(=O)[C@@]2(C)CO2)cc1 Homo sapiens CHEMBL4403371 single protein format
CHEMBL371405 OBDepict Cl H O NH H 3 C O O OH H H IC50 = 430.0 nM 313.78 C[C@@]12OC(=O)[C@]1([C@@H](O)[C@@H]1C=CCCC1)NC(=O)[C@@H]2CCCl Homo sapiens CHEMBL2184802 single protein format
CHEMBL3099618 OBDepict CH 3 O O N N IC50 = 430.0 nM 566.83 CCC(=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1)c1ccccc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL4091983 OBDepict CH 3 CH 3 B HN H HO HO O NH H N H O Cl Cl IC50 = 480.0 nM 480.2 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1cc(Cl)ccc1Cl)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL4092241 OBDepict H N H H N IC50 = 480.0 nM 382.64 C1=C2CN3CCCC/C=CCC[C@@H]4CN(CCCC/C=CCC[C@H]1C3)CC[C@@H]24 Homo sapiens CHEMBL4310877 cell-based format
CHEMBL2385812 OBDepict CH 3 H 3 C B N H H OH HO O N O N O Ki = 520.0 nM 351.21 CC(C)C[C@H](NC(=O)Cn1ccc(N2CCOCC2)cc1=O)B(O)O Homo sapiens CHEMBL2388792 single protein format
CHEMBL4451593 OBDepict H 3 C CH 3 N H H N H O O H N H H O N O CH 3 H 3 C O O CH 3 H 3 C O IC50 = 560.0 nM 588.75 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)C(=O)N1CCOCC1 Homo sapiens CHEMBL4399424 assay format
CHEMBL4649310 OBDepict H 3 C CH 3 N H H O CH 3 O O N H H O H N O HN O N N IC50 = 589.9 nM 578.67 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)c1cnccn1)C(=O)[C@@]1(C)CO1 Homo sapiens CHEMBL4605212 single protein format
CHEMBL64925 OBDepict O N H H O CH 3 H 3 C HN H O CH 3 CH 3 N H H O O H 3 C CH 3 IC50 = 600.0 nM 475.63 CC(C)C[C@@H](C=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OCc1ccccc1 Homo sapiens CHEMBL2345511 cell-based format
CHEMBL3128141 OBDepict O O H 3 C CH 3 N NH IC50 = 600.0 nM 268.32 CC1(C)OC(=O)c2c1ccnc2NCc1ccccc1 Homo sapiens CHEMBL3129429 cell-based format
CHEMBL4793363 OBDepict CH 3 H 3 C N H H N H O O H N H H O NH O H 3 C CH 3 O O H 3 C CH 3 IC50 = 610.9 nM 594.75 CC(C)C[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)C(=O)Nc1ccccc1 Homo sapiens CHEMBL4739048 tissue-based format
CHEMBL3099636 OBDepict N O O N IC50 = 630.0 nM 450.67 c1cc(OCCN2CCCCCC2)ccc1Cc1ccc(OCCN2CCCCCC2)cc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL2337881 OBDepict CH 2 HN H H O H N H O H O H O H 3 C H CH 3 IC50 = 670.0 nM 434.54 C=C[C@H](C[C@@H]1C[C@@H]1NC(=O)[C@@H]1OC(=O)[C@H]1[C@@H](C)CC)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL2343627 single protein format
CHEMBL3099624 OBDepict N O O N Ki = 670.0 nM 538.78 C(=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1)c1ccccc1 Homo sapiens CHEMBL3100299 single protein format
CHEMBL2338308 OBDepict H 2 C NH H H O H NH N H H 3 C H O O H O H O CH 3 H CH 3 IC50 = 690.0 nM 505.62 C=C[C@H](C[C@@H]1C[C@@H]1NC(=O)[C@@H]1OC(=O)[C@H]1[C@@H](C)CC)NC(=O)[C@H](C)NC(=O)c1ccc2ccccc2c1 Homo sapiens CHEMBL2343627 single protein format
CHEMBL3287937 OBDepict H 3 C CH 3 B NH H HO OH O N O N Ki = 690.0 nM 331.18 CC(C)C[C@H](NC(=O)CCn1ccc2ncccc2c1=O)B(O)O Homo sapiens CHEMBL3296842 cell-based format
CHEMBL3099638 OBDepict H 3 C CH 3 O O N N IC50 = 770.0 nM 478.72 CC(C)(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL3099637 OBDepict CH 3 O O N N IC50 = 790.0 nM 464.69 CC(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL4065491 OBDepict CH 3 CH 3 B HN H HO HO O NH H N H O N N IC50 = 790.0 nM 413.29 CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)NCc1cnccn1)B(O)O Homo sapiens CHEMBL4042189 cell-based format
CHEMBL3099631 OBDepict CH 3 O O N N CH 3 IC50 = 840.0 nM 518.79 CCC(CC)=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL3099623 OBDepict H 3 C O O N N IC50 = 870.0 nM 552.8 CC(=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1)c1ccccc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL3099625 OBDepict O O N N IC50 = 890.0 nM 530.8 c1cc(C(=C2CCCCC2)c2ccc(OCCN3CCCCCC3)cc2)ccc1OCCN1CCCCCC1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL3099635 OBDepict CH 2 O O N N IC50 = 910.0 nM 462.68 C=C(c1ccc(OCCN2CCCCCC2)cc1)c1ccc(OCCN2CCCCCC2)cc1 Homo sapiens CHEMBL3100302 single protein format
CHEMBL3287939 OBDepict CH 3 H 3 C B N H H OH HO O N O Ki = 990.0 nM 316.17 CC(C)C[C@H](NC(=O)Cn1ccc2ccccc2c1=O)B(O)O Homo sapiens CHEMBL3296842 cell-based format