Found 115 hits Enz. Inhib. hit(s) with Target = 'Mannan-binding lectin serine protease 1' Target/Host
(Institution) | Ligand | Target/Host
Links | Ligand
Links | Trg + Lig
Links | Ki
nM | ΔG°
kJ/mole | IC50
nM | Kd
nM | EC50/IC50
nM | koff
s-1 | kon
M-1s-1 | pH | Temp
°C |
|---|
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM50462088
(CHEMBL4250967)Show SMILES CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](NC(=O)[C@H](CS)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCCN)NC(=O)CNC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CO)NC(=O)CNC(=O)[C@H](CS)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CS)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CS)NC(=O)[C@@H](NC(=O)[C@@H](N)C(C)C)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CS)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)N[C@@H](CCC(N)=O)C(O)=O |r| Show InChI InChI=1S/C154H248N46O51S6/c1-72(2)54-92(131(229)191-103(68-254)141(239)183-94(57-82-39-41-83(208)42-40-82)133(231)180-91(152(250)251)43-45-108(159)209)182-127(225)85(33-18-22-48-156)174-126(224)89(37-26-52-167-154(164)165)178-146(244)118(76(7)204)197-143(241)106(71-257)192-134(232)93(55-80-28-13-11-14-29-80)181-122(220)74(5)171-137(235)100(65-202)188-125(223)84(32-17-21-47-155)172-110(211)61-168-123(221)97(59-114(216)217)185-138(236)99(64-201)173-111(212)62-169-124(222)101(66-252)189-130(228)88(36-25-51-166-153(162)163)177-139(237)104(69-255)193-148(246)119(77(8)205)196-136(234)96(58-109(160)210)184-142(240)102(67-253)190-129(227)87(35-20-24-50-158)176-135(233)98(60-115(218)219)186-128(226)86(34-19-23-49-157)175-132(230)95(56-81-30-15-12-16-31-81)187-147(245)121(79(10)207)199-150(248)117(75(6)203)195-112(213)63-170-144(242)107-38-27-53-200(107)151(249)90(44-46-113(214)215)179-140(238)105(70-256)194-149(247)120(78(9)206)198-145(243)116(161)73(3)4/h11-16,28-31,39-42,72-79,84-107,116-121,201-208,252-257H,17-27,32-38,43-71,155-158,161H2,1-10H3,(H2,159,209)(H2,160,210)(H,168,221)(H,169,222)(H,170,242)(H,171,235)(H,172,211)(H,173,212)(H,174,224)(H,175,230)(H,176,233)(H,177,237)(H,178,244)(H,179,238)(H,180,231)(H,181,220)(H,182,225)(H,183,239)(H,184,240)(H,185,236)(H,186,226)(H,187,245)(H,188,223)(H,189,228)(H,190,227)(H,191,229)(H,192,232)(H,193,246)(H,194,247)(H,195,213)(H,196,234)(H,197,241)(H,198,243)(H,199,248)(H,214,215)(H,216,217)(H,218,219)(H,250,251)(H4,162,163,166)(H4,164,165,167)/t74-,75+,76+,77+,78+,79+,84-,85-,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,116-,117-,118-,119-,120-,121-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| 7 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Queensland
Curated by ChEMBL
| Assay Description
Inhibition of recombinant CP1-CCP2-SP fragment of MASP-1 (unknown origin) |
J Med Chem 61: 3253-3276 (2018)
Article DOI: 10.1021/acs.jmedchem.7b00882
BindingDB Entry DOI: 10.7270/Q2MK6GJ9 |
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM50462102
(CHEMBL4240381)Show SMILES CC[C@H](C)[C@H](NC(=O)CN)C(=O)N[C@@H](CS)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CS)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(O)=O |r| Show InChI InChI=1S/C63H107N17O19S2/c1-9-32(6)47(75-45(83)26-64)57(93)73-40(29-100)53(89)72-38(27-81)51(87)68-35(16-12-20-67-63(65)66)50(86)71-39(28-82)52(88)69-36(24-31(4)5)59(95)80-23-15-19-44(80)60(96)78-21-13-18-43(78)56(92)76-48(33(7)10-2)58(94)74-41(30-101)54(90)77-49(34(8)11-3)61(97)79-22-14-17-42(79)55(91)70-37(62(98)99)25-46(84)85/h31-44,47-49,81-82,100-101H,9-30,64H2,1-8H3,(H,68,87)(H,69,88)(H,70,91)(H,71,86)(H,72,89)(H,73,93)(H,74,94)(H,75,83)(H,76,92)(H,77,90)(H,84,85)(H,98,99)(H4,65,66,67)/t32-,33-,34-,35-,36-,37-,38-,39-,40-,41-,42-,43-,44-,47-,48-,49-/m0/s1 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| KEGG
PC cid
PC sid
UniChem
| Article
PubMed
| 65 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Queensland
Curated by ChEMBL
| Assay Description
Inhibition of MASP-1 (unknown origin) using Z-L-LysSBzl hydrochloride as substrate preincubated for 1 hr followed by substrate addition |
J Med Chem 61: 3253-3276 (2018)
Article DOI: 10.1021/acs.jmedchem.7b00882
BindingDB Entry DOI: 10.7270/Q2MK6GJ9 |
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645085
(US20240010684, Ex. No 61)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)NCCC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645091
(US20240010684, Ex. No 67)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCCCC[C@H](N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 3.25 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645059
(US20240010684, Ex. No 35)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CCCNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645068
(US20240010684, Ex. No 44)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](C)NC(=O)[C@@H](N)CCCNC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)C(NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 4.70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645120
(US20240010684, Ex. No 97)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CN)C(=O)N[C@@H](CN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645112
(US20240010684, Ex. No 89)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CN)C(=O)N[C@@H](CN)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645065
(US20240010684, Ex. No 41)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)N[C@@H](C)C(=O)NC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 5.90 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645063
(US20240010684, Ex. No 39)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645092
(US20240010684, Ex. No 68)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](COC)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)NC(=O)N1CCC[C@H]1C(=O)NCCCCC(=O)Nc1ccc(cc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645095
(US20240010684, Ex. No 72)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)NC(=O)[C@H](CO)NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)CCCCNC(=O)[C@@H](NC(=O)[C@@H](NC1=O)C(C)(C)SS2)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645075
(US20240010684, Ex. No 51)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CCCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.30 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645067
(US20240010684, Ex. No 43)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)[C@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)NCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645077
(US20240010684, Ex. No 53)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 6.75 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645064
(US20240010684, Ex. No 40)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CCNC(=O)CCCCCCNC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645098
(US20240010684, Ex. No 75)Show SMILES CC[C@H](C)[C@@H]1CC(=O)CCCCNC(=O)CC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCCCC4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645076
(US20240010684, Ex. No 52)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CCCCCNC(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 7.90 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645090
(US20240010684, Ex. No 66)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)CCC(=O)[C@H](CSSC2(C)C)NC(=O)C(NC(=O)[C@H](N)CCCNC1=O)C(C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645071
(US20240010684, Ex. No 47)Show SMILES CC[C@H](C)[C@@H]1NC(=O)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)NCCCCC(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.20 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645115
(US20240010684, Ex. No 92)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645078
(US20240010684, Ex. No 54)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CN(C)C(=O)CCCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.5 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645053
(US20240010684, Ex. No 29)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.60 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645060
(US20240010684, Ex. No 36)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CCCNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 8.70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645082
(US20240010684, Ex. No 58)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645051
(US20240010684, Ex. No 27)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)NCCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645088
(US20240010684, Ex. No 64)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CN(C)C(=O)CCCCCNC(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.40 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645099
(US20240010684, Ex. No 76)Show SMILES CCCCN1C(=O)N[C@@H](CC(=O)NCCCCC(=O)NCC(=O)N(C)C(=O)NC([C@@H](C)CC)C(=O)N[C@H]2CSSC(C)(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC2=O)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C1=O)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.70 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645113
(US20240010684, Ex. No 90)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)[C@@H](N)CCC(=O)NCCCCC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 9.80 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645072
(US20240010684, Ex. No 48)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CCCNC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645101
(US20240010684, Ex. No 78)Show SMILES CC[C@H](C)[C@H]1NC(=O)[C@@H]2CCCN2C(=O)CCCCNC(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCCCC[C@@H](N)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 10 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645100
(US20240010684, Ex. No 77)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2C[C@@H]3CCCC[C@H]3N2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)NCCCC(=O)NCC(=O)N(C)[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645083
(US20240010684, Ex. No 59)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)NCCCCCC(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r,wU:48.50,4.3,2.2,22.24,31.33,37.39,101.106,102.107,92.96,68.71,69.72,wD:61.63,8.12,15.20,54.113,95.98,79.82,(-1.83,-10.97,;-1.06,-9.64,;.48,-9.64,;1.03,-11.08,;1.46,-8.45,;2.79,-8.8,;4.46,-8.89,;4.42,-10.43,;6,-8.89,;5.35,-7.49,;6.49,-6.43,;7.85,-7.19,;7.54,-8.71,;9.08,-8.17,;9.85,-9.51,;10.21,-7.41,;8.83,-6.84,;8.95,-5.35,;10.41,-5.01,;11.18,-6.28,;11.91,-4.83,;13.24,-5.6,;12.14,-3.5,;13.63,-3.9,;14.71,-2.81,;15.11,-1.32,;16.05,-3.58,;16.2,-2.41,;12.18,-2.19,;12.03,-.7,;13.52,-.31,;11.67,.66,;13.01,1.43,;13.01,2.97,;10.95,2.02,;9.65,3.32,;10.6,4.48,;8.34,4.11,;8.55,5.65,;7.34,6.6,;7.56,8.13,;6.34,9.08,;6.56,10.6,;7.98,11.18,;5.34,11.55,;6.57,4.74,;5.03,4.85,;5.08,6.39,;3.33,4.78,;3.22,6.31,;1.74,6.71,;1.61,4.47,;.12,3.71,;-.65,5.05,;-.85,2.76,;-1.76,1.13,;-2.35,-.56,;-2.38,-2.23,;-2.24,-3.9,;-3.57,-3.13,;-3.73,-4.48,;-1.88,-5.26,;-1.3,-6.57,;.01,-7.72,;-.83,-9.01,;-2.55,-6.41,;-1.46,-7.5,;-3.67,-7.18,;-5.16,-7.51,;-4.85,-9.02,;-3.38,-9.5,;-6,-10.04,;-5.68,-11.55,;-6.64,-7.62,;-6.53,-9.15,;-8.18,-7.62,;-7.52,-6.27,;-8.59,-5.22,;-9.92,-5.92,;-9.67,-7.4,;-11.16,-7,;-11.75,-8.42,;-12.49,-6.23,;-13.58,-4.96,;-14.35,-3.63,;-14.75,-2.14,;-14.93,-.6,;-14.93,.94,;-14.71,2.43,;-16.2,2.82,;-14.13,3.91,;-13.05,4.86,;-11.71,5.77,;-11.13,7.26,;-9.65,7.66,;-8.38,6.71,;-8.95,5.08,;-10.44,4.68,;-7.02,6.75,;-6.9,8.29,;-5.53,6.53,;-4.04,6.13,;-3.27,7.38,;-4,8.73,;-1.73,7.33,;-.92,8.64,;-2.71,5.36,;-1.77,6.59,;-1.49,4.18,)| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645103
(US20240010684, Ex. No 80)Show SMILES CCCCN1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]2C(C)SS[C@H](NC(=O)[C@@H](NC(=O)[C@H](N)CCCCNC(=O)[C@@H](NC2=O)[C@@H](C)CC)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N2CCC[C@H]2C1=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
|
More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645058
(US20240010684, Ex. No 34)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)NCOCOCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 11 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645050
(US20240010684, Ex. No 26)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CCCCCN)C(=O)N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CCCNC(=N)NS(=O)(=O)c1c(C)c2CC(C)(C)Oc2c(C)c1C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)OC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 12 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
Citation and Details
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645066
(US20240010684, Ex. No 42)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)NC(=O)[C@H](C)NC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645074
(US20240010684, Ex. No 50)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CSSC[C@H](N)C(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 13 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645097
(US20240010684, Ex. No 74)Show SMILES CCCCN1C(=O)N[C@@H](CCC(=O)NCCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]2CSSC(C)(C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCCC4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC2=O)[C@@H](C)CC)C(=O)N[C@@H]([C@@H](C)CC)C1=O)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 14 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645107
(US20240010684, Ex. No 84)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2C[C@@H]3CCCC[C@@H]3N2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(=O)NCCCCC(=O)NC(=O)N[C@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 15 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645055
(US20240010684, Ex. No 31)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@H](C)NC(=O)CNC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)NCCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645054
(US20240010684, Ex. No 30)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CCCCCNC(=O)[C@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@@H]2SSC[C@H](NC1=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2C)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645061
(US20240010684, Ex. No 37)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 16 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645104
(US20240010684, Ex. No 81)Show SMILES CCCCN1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H]2SS[C@H](NC(=O)[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)n3cc(C[C@H](NC(=O)[C@@H]4CCCN4C(=O)[C@@H](NC2=O)[C@@H](C)CC)C(N)=O)nn3)OC)[C@@H](C)CC)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)(C)C)C(=O)N2CCC[C@H]2C1=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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More data for this
Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645106
(US20240010684, Ex. No 83)Show SMILES CC[C@H](C)[C@@H]1NC(=O)NC(=O)CCCCNC(=O)CC[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 18 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Ligand-Target Pair | |
Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645121
(US20240010684, Ex. No 98)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CNC(=O)[C@H](C)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
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| |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645073
(US20240010684, Ex. No 49)Show SMILES CC[C@H](C)[C@@H]1NC(=O)CNC(=O)CCCCNC(=O)C[C@H](NC(=O)[C@@H]2CCCN2C(=O)[C@@H](NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)[C@@H]3C[C@@H]4CCCC[C@@H]4N3C(=O)[C@@H]3CCCN3C(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CSSC2(C)C)NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
TBA
| |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645052
(US20240010684, Ex. No 28)Show SMILES CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)CCCCCNC(=O)C1CCCN1)C(=O)N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CCCNC(=N)NS(=O)(=O)c1c(C)c2CC(C)(C)Oc2c(C)c1C)C(=O)N[C@@H](COC(C)(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N1CCC[C@H]1C(=O)N1[C@H]2CCCC[C@H]2C[C@H]1C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CSC(c1ccccc1)(c1ccccc1)c1ccccc1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)OC |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 19 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645093
(US20240010684, Ex. No 69)Show SMILES CCCCN1C(=O)CCCCNC(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H]2NC(=O)[C@@H](NC(=O)CNC(=O)[C@H]3CC[C@@H](CC3)NC(=O)NC(=O)[C@H](NC(=O)[C@@H]3CCCN3C(=O)[C@@H](NC(=O)[C@H](CSS2)N(C)C(=O)[C@@H](NC1=O)[C@@H](C)CC)[C@@H](C)CC)C(N)=O)[C@@H](C)CC |r,wU:14.14,29.29,70.108,58.58,101.105,108.112,wD:23.23,85.91,93.100,97.101,74.79,61.61,81.104,40.40,46.46,50.50,(-6.92,-8.52,;-5.34,-8.17,;-4.07,-7.05,;-2.43,-6.57,;-1.9,-5.21,;-3.36,-5.22,;-3.35,-6.43,;-4.66,-4.5,;-6.3,-4.25,;-7.65,-3.56,;-7.62,-2.35,;-5.77,-2.22,;-4.08,-2.38,;-3.26,-3.75,;-2.6,-1.97,;-2.69,-.54,;-2.89,1,;-3.59,2.61,;-3.7,.04,;-1.63,2.12,;-1.23,-1.29,;.46,-1.16,;1.4,.06,;1.88,-1.69,;1,-2.98,;2.03,-4.13,;3.21,-2.28,;4.11,-3.43,;3.27,-4.63,;5.59,-3.52,;6.98,-5.04,;8.64,-5.8,;10.38,-5.38,;11.76,-6.1,;12.92,-5.04,;13.37,-3.56,;14.31,-5.58,;7.29,-3.53,;8.84,-2.82,;10.19,-1.68,;8.37,-4,;9.35,-5.36,;10.58,-6.53,;7.63,-2.43,;6.28,-1.35,;5.19,-2.35,;5.25,-.2,;5.5,1.29,;6.5,2.42,;6.31,3.94,;7.78,1.66,;8.09,.2,;7.49,-1.22,;9.1,-1.77,;6.52,-2.65,;6.43,-4.38,;6.42,-5.94,;7.07,-7.4,;5.74,-7.29,;5.82,-8.77,;4.58,-9.6,;3.19,-8.98,;3.17,-7.5,;4.39,-6.68,;1.7,-9.37,;.18,-9.43,;.49,-11.01,;-1.33,-9.24,;-2.78,-8.74,;-3.06,-10.32,;-4.08,-7.9,;-5.06,-6.68,;-5.47,-5.15,;-7.21,-5.75,;-5.12,-3.07,;-6.56,-3.31,;-7.24,-2,;-6.21,-.96,;-4.9,-1.62,;-4.69,-.09,;-5.91,.97,;-4.04,1.27,;-2.61,1.73,;-1.27,1.02,;-.89,2.8,;-.28,-.16,;.97,.76,;2.46,.96,;3.83,.32,;-.27,-1.89,;-1.29,-2.67,;.2,-3.33,;-.27,-4.98,;.95,-4.61,;.31,-5.94,;-1.07,-6.41,;-.51,-8.11,;2.25,-5.07,;3.15,-6.55,;3.01,-3.53,;2,-2.58,;-5.09,2.72,;-6.56,3.23,;-5.29,4.36,;-6.29,5.54,;-5.32,-9.39,;-6.72,-10.15,;-5.43,-10.97,;8.97,2.75,;8.92,4.28,;10.53,2.9,;11.57,4.01,)| | PDB
UniProtKB/SwissProt
GoogleScholar
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| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
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Mannan-binding lectin serine protease 1
(Homo sapiens) | BDBM645062
(US20240010684, Ex. No 38)Show SMILES CC[C@H](C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)(C)C)NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@@H]2CSSC(C)(C)[C@H](NC1=O)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC(O)=O)C(=O)NCCCC(=O)N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N2 |r| | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| | n/a | n/a | 20 | n/a | n/a | n/a | n/a | n/a | n/a |
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