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Name | Substance-P receptor |
---|---|
Species | Homo sapiens (Human) |
Gene | TACR1 |
Synonym | NK-1 receptor Tachykinin receptor 1 TAC1R SPR Substance P receptor [ Show all ] |
Disease | Cough Depression Depression; Anxiety Diabetes Eczema [ Show all ] |
Length | 407 |
Amino acid sequence | MDNVLPVDSDLSPNISTNTSEPNQFVQPAWQIVLWAAAYTVIVVTSVVGNVVVMWIILAHKRMRTVTNYFLVNLAFAEASMAAFNTVVNFTYAVHNEWYYGLFYCKFHNFFPIAAVFASIYSMTAVAFDRYMAIIHPLQPRLSATATKVVICVIWVLALLLAFPQGYYSTTETMPSRVVCMIEWPEHPNKIYEKVYHICVTVLIYFLPLLVIGYAYTVVGITLWASEIPGDSSDRYHEQVSAKRKVVKMMIVVVCTFAICWLPFHIFFLLPYINPDLYLKKFIQQVYLAIMWLAMSSTMYNPIIYCCLNDRFRLGFKHAFRCCPFISAGDYEGLEMKSTRYLQTQGSVYKVSRLETTISTVVGAHEEEPEDGPKATPSSLDLTSNCSSRSDSKTMTESFSFSSNVLS |
UniProt | P25103 |
Protein Data Bank | 2ksa, 6e59, 6hlo, 2ks9, 6hlp, 6hll, 2ksb |
GPCR-HGmod model | P25103 |
3D structure model | This structure is from PDB ID 2ksa. |
BioLiP | BL0101802, BL0437915, BL0437914, BL0437913, BL0434896, BL0101803, BL0101801 |
Therapeutic Target Database | T47094 |
ChEMBL | CHEMBL249 |
IUPHAR | 360 |
DrugBank | BE0000384 |
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GLASS ID | Molecule | Formula | Molecular weight | H-bond acceptor / donor | XlogP | Lipinski's druglikeness |
---|---|---|---|---|---|---|
312 | CHEMBL358600 | C27H32Cl2FN3O2 | 520.47 | 5 / 0 | 4.3 | No |
347 | CHEMBL1097693 | C23H21F7N2O2 | 490.422 | 10 / 1 | 4.3 | Yes |
396 | CHEMBL3288163 | C34H39Cl3FN5O4 | 707.065 | 7 / 4 | N/A | No |
777 | CHEMBL408242 | C36H37Cl2N3O2S | 646.671 | 5 / 0 | 7.5 | No |
1038 | CHEMBL21607 | C28H27Cl2N3O2 | 508.443 | 3 / 1 | 6.1 | No |
1104 | CHEMBL143156 | C27H30F6N2O2 | 528.539 | 9 / 0 | 5.6 | No |
1179 | CHEMBL134737 | C28H28ClN3O3 | 490.0 | 3 / 3 | 5.6 | No |
1274 | CHEMBL418757 | C51H52FN7O7 | 894.017 | 8 / 7 | 6.6 | No |
1512 | CHEMBL556537 | C70H89F6N11O15 | 1438.53 | 22 / 14 | 5.8 | No |
1580 | CHEMBL417766 | C28H33NO | 399.578 | 2 / 1 | 6.1 | No |
1623 | CHEMBL21939 | C35H35N3O2 | 529.684 | 3 / 1 | 7.0 | No |
1720 | CHEMBL2373196 | C34H36Cl2N2O2S | 607.634 | 4 / 0 | 7.4 | No |
1836 | CHEMBL2304114 | C97H126N18O19S | 1880.24 | 21 / 15 | 7.8 | No |
1876 | CHEMBL327928 | C21H25NO2 | 323.436 | 3 / 1 | 3.4 | Yes |
1889 | CHEMBL76455 | C32H33N3O4 | 523.633 | 4 / 3 | 6.3 | No |
2342 | CHEMBL59310 | C26H29NO2 | 387.523 | 2 / 1 | 5.1 | No |
2488 | Substance P | C63H98N18O13S | 1347.65 | 17 / 15 | -2.3 | No |
2798 | sub-stance p | C63H98N18O13S | 1347.65 | 17 / 15 | -2.3 | No |
463228 | CHEMBL3609619 | C32H30F6N4O5 | 664.605 | 12 / 5 | 4.5 | No |
3121 | CHEMBL400148 | C26H24F7NO2 | 515.472 | 10 / 0 | 6.2 | No |
3175 | CHEMBL557188 | C60H72F6N10O9 | 1191.29 | 16 / 10 | 7.4 | No |
3187 | CHEMBL42653 | C31H32ClN3O4 | 546.064 | 4 / 2 | 4.5 | No |
3200 | CHEMBL26790 | C33H36Cl2N4O2 | 591.577 | 3 / 1 | 6.1 | No |
3429 | CHEMBL288371 | C28H28N2O2S | 456.604 | 4 / 1 | 4.7 | Yes |
3447 | CHEMBL337789 | C25H29F6N3O3 | 533.515 | 11 / 1 | 3.5 | No |
3448 | CHEMBL1084165 | C29H30ClF6N3O3 | 618.017 | 11 / 2 | 6.2 | No |
3515 | CHEMBL166827 | C32H40Cl4N4O6S | 750.554 | 8 / 1 | 3.7 | No |
3849 | CEP-11981 | C28H27N7O | 477.572 | 5 / 2 | 3.9 | Yes |
3973 | CHEMBL341681 | C28H27F2N3O3 | 491.539 | 5 / 3 | 5.2 | No |
4672 | CHEMBL1765500 | C28H28F6N4O | 550.549 | 10 / 0 | 5.9 | No |
463457 | CHEMBL3596492 | C28H27F3N2O | 464.532 | 6 / 0 | 6.1 | No |
4838 | CHEMBL2112211 | C30H27F6N3O3 | 591.554 | 9 / 2 | 6.2 | No |
5216 | CHEMBL296014 | C32H47N3O5 | 553.744 | 5 / 4 | 5.6 | No |
5397 | CHEMBL42800 | C23H23F6N3O2 | 487.446 | 9 / 2 | 4.1 | Yes |
5405 | CHEMBL137972 | C29H41N3O2 | 463.666 | 4 / 1 | 4.8 | Yes |
5705 | CHEMBL357303 | C19H20Cl2N4O2 | 407.295 | 4 / 2 | 3.4 | Yes |
5755 | paroxetine | C19H20FNO3 | 329.371 | 5 / 1 | 3.5 | Yes |
6022 | CHEMBL336251 | C25H30F6N2O | 488.518 | 9 / 0 | 6.0 | No |
6026 | CHEMBL313070 | C24H26F6N2O | 472.475 | 8 / 1 | 5.4 | No |
6045 | CHEMBL75367 | C32H38Cl2F6N4O4 | 727.57 | 13 / 1 | 6.0 | No |
6047 | CHEMBL75436 | C32H38Cl2F6N4O4 | 727.57 | 13 / 1 | 6.0 | No |
6179 | CHEMBL317297 | C30H34N2O2 | 454.614 | 4 / 1 | 5.6 | No |
6195 | CHEMBL420876 | C29H32N2 | 408.589 | 2 / 1 | 6.0 | No |
6196 | CHEMBL316842 | C29H32N2 | 408.589 | 2 / 1 | 6.0 | No |
6452 | CHEMBL445357 | C30H33Cl2N3O3S2 | 618.632 | 6 / 1 | 5.4 | No |
6649 | CHEMBL54540 | C30H31Cl4N3O4S | 671.455 | 6 / 1 | 5.9 | No |
7266 | CHEMBL2112245 | C74H92FN15O17S2 | 1546.76 | 22 / 19 | -0.3 | No |
7547 | CHEMBL139256 | C28H36F3N3O2 | 503.61 | 7 / 1 | 5.2 | No |
7953 | CHEMBL106300 | C34H39Cl2N5O3 | 636.618 | 5 / 2 | 4.6 | No |
7954 | CHEMBL107306 | C34H39Cl2N5O3 | 636.618 | 5 / 2 | 4.6 | No |
7957 | CHEMBL423597 | C19H24N2O | 296.414 | 3 / 2 | 2.7 | Yes |
8035 | CHEMBL2370513 | C42H54N8O9 | 814.941 | 9 / 8 | 2.9 | No |
8221 | CHEMBL1951633 | C24H24F7N3O2 | 519.464 | 9 / 1 | 4.2 | No |
8304 | CHEMBL209531 | C22H23F6NO | 431.422 | 8 / 1 | 5.5 | No |
8427 | CHEMBL3144347 | C42H46N6O7 | 746.865 | 7 / 3 | 4.2 | No |
8432 | CHEMBL45085 | C42H46N6O7 | 746.865 | 7 / 3 | 4.2 | No |
8982 | CHEMBL20826 | C29H30ClN3O2 | 488.028 | 3 / 1 | 4.6 | Yes |
9058 | CHEMBL207698 | C23H23F6NO | 443.433 | 8 / 1 | 5.8 | No |
9059 | CHEMBL382988 | C23H23F6NO | 443.433 | 8 / 1 | 5.8 | No |
9142 | CHEMBL208900 | C27H25N3O2 | 423.516 | 3 / 1 | 3.9 | Yes |
9226 | CHEMBL317209 | C25H23F6N3O3S | 559.527 | 11 / 0 | 3.5 | No |
9301 | CHEMBL20736 | C35H34ClN3O2 | 564.126 | 3 / 1 | 6.2 | No |
9359 | CHEMBL120589 | C22H25NO | 319.448 | 2 / 1 | 4.6 | Yes |
9360 | CHEMBL68670 | C22H25NO | 319.448 | 2 / 1 | 4.6 | Yes |
9429 | CHEMBL301618 | C33H33F7N2O | 606.629 | 9 / 1 | 8.4 | No |
9451 | CHEMBL319474 | C33H38Cl2N4O4 | 625.591 | 6 / 1 | 5.1 | No |
9776 | CHEMBL380510 | C30H32F6N4O | 578.603 | 10 / 0 | 7.1 | No |
9820 | CHEMBL1270464 | C26H26F6N4O | 524.511 | 11 / 2 | 5.5 | No |
9869 | AC-42 | C20H31NO | 301.474 | 2 / 0 | 5.2 | No |
9956 | CHEMBL387670 | C61H73F6N9O10 | 1206.3 | 17 / 8 | 8.1 | No |
10040 | CHEMBL144793 | C25H32N4O | 404.558 | 4 / 2 | 3.7 | Yes |
557571 | SCHEMBL17254991 | C34H35F7N2O4 | 668.653 | 12 / 2 | 7.2 | No |
10200 | CHEMBL1090438 | C29H28F7NO3 | 571.536 | 10 / 0 | 5.5 | No |
10246 | CHEMBL168144 | C34H40Cl4N6O3 | 722.533 | 6 / 0 | 6.4 | No |
10603 | CHEMBL56372 | C23H24BrNO | 410.355 | 2 / 1 | 5.2 | No |
521746 | CHEMBL3735396 | C41H57N7O11S | 856.005 | 12 / 8 | 1.5 | No |
521749 | CHEMBL3735210 | C41H57N7O11S | 856.005 | 12 / 8 | 1.5 | No |
11050 | CHEMBL2333642 | C19H19ClF4N2O | 402.818 | 7 / 1 | 4.3 | Yes |
11074 | CHEMBL287369 | C33H40Cl4N8O3 | 738.536 | 8 / 0 | 6.4 | No |
11141 | CHEMBL139057 | C29H39N3O4 | 493.648 | 6 / 0 | 4.1 | Yes |
12343 | CHEMBL203113 | C33H33F6N5O3 | 661.649 | 10 / 3 | 5.4 | No |
12445 | CHEMBL41068 | C35H42Cl2F6N4O5 | 783.634 | 14 / 0 | 7.0 | No |
12539 | CHEMBL105847 | C36H37ClN4O2S | 625.228 | 3 / 2 | 6.8 | No |
521828 | CHEMBL3736313 | C40H56N8O11S | 856.993 | 13 / 9 | -2.0 | No |
12653 | CHEMBL1917867 | C26H30F3N7O3 | 545.567 | 10 / 1 | 2.5 | No |
12963 | CHEMBL1817830 | C26H26ClF2NO2 | 457.946 | 5 / 1 | N/A | N/A |
13477 | CHEMBL151356 | C33H42Cl2N4O2 | 597.625 | 4 / 1 | 5.0 | No |
13533 | CHEMBL424301 | C20H24N6O | 364.453 | 6 / 2 | 2.8 | Yes |
13712 | CHEMBL342341 | C32H38Cl2F6N4O3 | 711.571 | 12 / 1 | 6.9 | No |
13771 | Aprepitant | C23H21F7N4O3 | 534.435 | 12 / 2 | 4.2 | No |
13773 | ent-Aprepitant | C23H21F7N4O3 | 534.435 | 12 / 2 | 4.2 | No |
14024 | CHEMBL1766208 | C61H74F6N10O9S | 1237.37 | 17 / 10 | 7.3 | No |
14089 | CHEMBL611925 | C57H64F6N10O9S2 | 1211.31 | 18 / 10 | 6.0 | No |
14093 | CHEMBL611924 | C57H64F6N10O9S2 | 1211.31 | 18 / 10 | 6.0 | No |
14107 | CHEMBL2114398 | C27H26ClF6N3O3 | 589.963 | 9 / 2 | 5.6 | No |
14110 | CHEMBL2112070 | C27H26ClF6N3O3 | 589.963 | 9 / 2 | 5.6 | No |
14111 | CHEMBL35857 | C27H26ClF6N3O3 | 589.963 | 9 / 2 | 5.6 | No |
14113 | CHEMBL104954 | C27H26ClF6N3O3 | 589.963 | 9 / 2 | 5.6 | No |
14115 | CHEMBL2115343 | C27H26ClF6N3O3 | 589.963 | 9 / 2 | 5.6 | No |
14137 | CHEMBL1090285 | C31H23F7N2O2 | 588.526 | 10 / 0 | 6.5 | No |
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