Drug ID:   | NPD8868 |
Drug Name:   | Hydroxyproline |
Molecular Formula:   | C5H9NO3 |
Canonical SMILES:   | O[C@@H]1CNC(C1)C(=O)O |
Standard InCHI:   | InChI=1S/C5H9NO3/c7-3-1-4(5(8)9)6-2-3/h3-4,6-7H,1-2H2,(H,8,9)/t3-,4?/m0/s1 |
Standard InCHIKey:   | PMMYEEVYMWASQN-WUCPZUCCSA-N |
Max Developmental Stage:   | Approved |
Max Developmental Stage Source:   | DrugBank |
Similarity level is defined by Tanimoto coefficient (Tc) between two molecules. Tc lies between [0, 1] where '1' indicates the highest similarity. What is Tanimoto coefficient
Tanimoto coefficient is calculated based on PubChem 881-bit substructure fingerprints.
High Similarity Level: Tc>=0.85; Intermediate Similarity Level: 0.7 <= Tc < 0.85; Remote Similarity Level: 0.65 <= Tc < 0.7
Similarity Level | Similarity Score | Natural Product ID |
---|---|---|
High Similarity | 1.0 | NPC221764 |
High Similarity | 1.0 | NPC135539 |
High Similarity | 1.0 | NPC78312 |
High Similarity | 1.0 | NPC196359 |
High Similarity | 0.875 | NPC160661 |
High Similarity | 0.8689 | NPC11433 |
High Similarity | 0.8689 | NPC302003 |
High Similarity | 0.8689 | NPC245346 |
Intermediate Similarity | 0.8358 | NPC107224 |
Intermediate Similarity | 0.7742 | NPC272396 |
Intermediate Similarity | 0.7656 | NPC65832 |
Intermediate Similarity | 0.7656 | NPC311668 |
Intermediate Similarity | 0.7656 | NPC10262 |
Intermediate Similarity | 0.7639 | NPC185084 |
Intermediate Similarity | 0.7465 | NPC15864 |
Intermediate Similarity | 0.7391 | NPC472609 |
Intermediate Similarity | 0.7286 | NPC287693 |
Intermediate Similarity | 0.7273 | NPC190385 |
Intermediate Similarity | 0.7222 | NPC322274 |
Intermediate Similarity | 0.7206 | NPC8087 |
Intermediate Similarity | 0.7206 | NPC57846 |
Intermediate Similarity | 0.7206 | NPC30126 |
Intermediate Similarity | 0.7206 | NPC474014 |
Intermediate Similarity | 0.7206 | NPC62507 |
Intermediate Similarity | 0.7164 | NPC268927 |
Intermediate Similarity | 0.7164 | NPC64250 |
Intermediate Similarity | 0.7164 | NPC276928 |
Intermediate Similarity | 0.7089 | NPC219340 |
Intermediate Similarity | 0.7067 | NPC320221 |
Intermediate Similarity | 0.7031 | NPC333075 |
Intermediate Similarity | 0.7031 | NPC274499 |
Intermediate Similarity | 0.7031 | NPC8488 |
Remote Similarity | 0.6935 | NPC93081 |
Remote Similarity | 0.6935 | NPC140872 |
Remote Similarity | 0.6901 | NPC474928 |
Remote Similarity | 0.6806 | NPC473952 |
Remote Similarity | 0.6806 | NPC116377 |
Remote Similarity | 0.6806 | NPC101746 |
Remote Similarity | 0.6806 | NPC69798 |
Remote Similarity | 0.6806 | NPC77191 |
Remote Similarity | 0.6761 | NPC88898 |
Remote Similarity | 0.6761 | NPC106216 |
Remote Similarity | 0.6753 | NPC327272 |
Remote Similarity | 0.6714 | NPC118429 |
Remote Similarity | 0.6667 | NPC469363 |
Remote Similarity | 0.6571 | NPC68974 |
Remote Similarity | 0.6567 | NPC275727 |
Remote Similarity | 0.6528 | NPC103130 |
Remote Similarity | 0.6528 | NPC226453 |
Remote Similarity | 0.6508 | NPC136159 |
Remote Similarity | 0.6508 | NPC101249 |
Remote Similarity | 0.6494 | NPC29326 |
Remote Similarity | 0.6452 | NPC327698 |
Remote Similarity | 0.6452 | NPC118459 |
Remote Similarity | 0.6447 | NPC473710 |
Remote Similarity | 0.6447 | NPC475694 |
Remote Similarity | 0.6429 | NPC290106 |
Remote Similarity | 0.6429 | NPC76726 |
Remote Similarity | 0.6429 | NPC143809 |
Remote Similarity | 0.6429 | NPC193593 |
Remote Similarity | 0.6418 | NPC183845 |
Remote Similarity | 0.6418 | NPC279661 |
Remote Similarity | 0.6393 | NPC276294 |
Remote Similarity | 0.6377 | NPC278209 |
Remote Similarity | 0.6364 | NPC255535 |
Remote Similarity | 0.6364 | NPC299603 |
Remote Similarity | 0.6364 | NPC200550 |
Remote Similarity | 0.6364 | NPC155156 |
Remote Similarity | 0.6364 | NPC137554 |
Remote Similarity | 0.6364 | NPC28959 |
Remote Similarity | 0.6364 | NPC285014 |
Remote Similarity | 0.6351 | NPC327985 |
Remote Similarity | 0.6308 | NPC270805 |
Remote Similarity | 0.6308 | NPC324825 |
Remote Similarity | 0.6308 | NPC93888 |
Remote Similarity | 0.6308 | NPC316231 |
Remote Similarity | 0.6308 | NPC112890 |
Remote Similarity | 0.629 | NPC198301 |
Remote Similarity | 0.6286 | NPC204709 |
Remote Similarity | 0.6282 | NPC474468 |
Remote Similarity | 0.625 | NPC322206 |
Remote Similarity | 0.6164 | NPC306462 |
Remote Similarity | 0.6164 | NPC150680 |
Remote Similarity | 0.6164 | NPC218150 |
Remote Similarity | 0.6164 | NPC22774 |
Remote Similarity | 0.6164 | NPC2432 |
Remote Similarity | 0.6164 | NPC69669 |
Remote Similarity | 0.6154 | NPC306973 |
Remote Similarity | 0.6133 | NPC315980 |
Remote Similarity | 0.6133 | NPC325534 |
Remote Similarity | 0.6111 | NPC177191 |
Remote Similarity | 0.6104 | NPC133183 |
Remote Similarity | 0.6092 | NPC90476 |
Remote Similarity | 0.6092 | NPC69374 |
Remote Similarity | 0.6076 | NPC55274 |
Remote Similarity | 0.6061 | NPC43204 |
Remote Similarity | 0.6061 | NPC162620 |
Remote Similarity | 0.6061 | NPC226027 |
Remote Similarity | 0.6061 | NPC245027 |
Remote Similarity | 0.6061 | NPC174246 |
Remote Similarity | 0.6061 | NPC84636 |
Remote Similarity | 0.6061 | NPC62045 |
Remote Similarity | 0.6056 | NPC43169 |
Remote Similarity | 0.6056 | NPC112224 |
Remote Similarity | 0.6056 | NPC327895 |
Remote Similarity | 0.6056 | NPC93861 |
Remote Similarity | 0.6 | NPC198341 |
Remote Similarity | 0.6 | NPC471892 |
Remote Similarity | 0.6 | NPC223386 |
Remote Similarity | 0.6 | NPC75435 |
Remote Similarity | 0.6 | NPC471780 |
Remote Similarity | 0.6 | NPC126186 |
Remote Similarity | 0.6 | NPC278881 |
Remote Similarity | 0.6 | NPC142290 |
Remote Similarity | 0.5976 | NPC315780 |
Remote Similarity | 0.597 | NPC273330 |
Remote Similarity | 0.597 | NPC137958 |
Remote Similarity | 0.5952 | NPC100204 |
Remote Similarity | 0.5952 | NPC83248 |
Remote Similarity | 0.5949 | NPC328457 |
Remote Similarity | 0.5942 | NPC322091 |
Remote Similarity | 0.5942 | NPC60672 |
Remote Similarity | 0.5938 | NPC208793 |
Remote Similarity | 0.5938 | NPC285322 |
Remote Similarity | 0.5921 | NPC303798 |
Remote Similarity | 0.5921 | NPC286851 |
Remote Similarity | 0.5909 | NPC153370 |
Remote Similarity | 0.5909 | NPC327542 |
Remote Similarity | 0.5889 | NPC322966 |
Remote Similarity | 0.5889 | NPC275715 |
Remote Similarity | 0.5882 | NPC470783 |
Remote Similarity | 0.5882 | NPC475542 |
Remote Similarity | 0.5857 | NPC2801 |
Remote Similarity | 0.5854 | NPC470782 |
Remote Similarity | 0.5846 | NPC309658 |
Remote Similarity | 0.5844 | NPC118524 |
Remote Similarity | 0.5833 | NPC189301 |
Remote Similarity | 0.5833 | NPC176164 |
Remote Similarity | 0.5806 | NPC326992 |
Remote Similarity | 0.5806 | NPC168375 |
Remote Similarity | 0.5806 | NPC121517 |
Remote Similarity | 0.5802 | NPC208657 |
Remote Similarity | 0.5797 | NPC190184 |
Remote Similarity | 0.5797 | NPC197087 |
Remote Similarity | 0.5789 | NPC233034 |
Remote Similarity | 0.5781 | NPC323974 |
Remote Similarity | 0.5775 | NPC325985 |
Remote Similarity | 0.5775 | NPC38463 |
Remote Similarity | 0.5769 | NPC471418 |
Remote Similarity | 0.5753 | NPC254541 |
Remote Similarity | 0.5753 | NPC473599 |
Remote Similarity | 0.5753 | NPC320598 |
Remote Similarity | 0.5747 | NPC165119 |
Remote Similarity | 0.5735 | NPC27359 |
Remote Similarity | 0.5735 | NPC295832 |
Remote Similarity | 0.5735 | NPC198398 |
Remote Similarity | 0.5714 | NPC233108 |
Remote Similarity | 0.5714 | NPC294883 |
Remote Similarity | 0.5714 | NPC37681 |
Remote Similarity | 0.5714 | NPC12514 |
Remote Similarity | 0.57 | NPC128303 |
Remote Similarity | 0.5696 | NPC268922 |
Remote Similarity | 0.5692 | NPC329263 |
Remote Similarity | 0.567 | NPC158394 |
Remote Similarity | 0.5658 | NPC315744 |
Remote Similarity | 0.5658 | NPC57420 |
Remote Similarity | 0.5644 | NPC241394 |
Remote Similarity | 0.5641 | NPC141156 |
Remote Similarity | 0.5641 | NPC184150 |
Remote Similarity | 0.5641 | NPC59221 |
Remote Similarity | 0.5634 | NPC327831 |
Remote Similarity | 0.5625 | NPC291186 |
Remote Similarity | 0.5625 | NPC167986 |
Remote Similarity | 0.5618 | NPC277918 |
Remote Similarity | 0.5604 | NPC52533 |
Remote Similarity | 0.56 | NPC314510 |
TTD   | |
DrugBank   | DB08847 |
ChEMBL   | CHEMBL352418 |
IUPHAR/BPS   | |
PharmaGKB   | |
KEGG Drug   | |
PubChem CID   | |
ChEBI   | 18095 |
CAS Number   | 51-35-4 |
Molecular Weight   | 131.06 |
ALogP   | -1.6044 |
MLogP   | 1.57 |
XLogP   | -0.786 |
HDA   | 4 |
HBD   | 3 |
Rotatable Bonds   | 3 |
TPSA   | 69.56 |
RO5 Violation   | 0 |