Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 5/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 3/20 | 0.44 |
| ▸ | RAB9A | P51151 | 3/20 | 0.44 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.43 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.43 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.43 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL9314213 | 0.92 | NPC1 (0.50) | MLYCDMAPK1ALDH1A1NPC1RAB9A | |
| Trifluoroacetic Acid SCHEMBL22121275 | 0.81 | MLYCD (0.56) | MLYCDNPC1RAB9AHDAC3HDAC1 | |
| SCHEMBL3523157 | 0.81 | MAPK1 (0.61) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL22488360 | 0.79 | HDAC3 (0.58) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL12960847 | 0.79 | MAPK1 (0.65) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL26709560 | 0.79 | MAPK1 (0.65) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL8353635 | 0.78 | MAPK1 (0.59) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL13857082 | 0.77 | HDAC3 (0.61) | MAPK1NPC1RAB9ACYP1A2TSHR | |
| SCHEMBL13566561 | 0.76 | MAPK1 (0.62) | MAPK1ALDH1A1NPC1RAB9ACYP1A2 | |
| SCHEMBL5855204 | 0.76 | HDAC1 (0.67) | MAPK1NPC1RAB9ANAMPTHDAC3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5280015-A | 2-substituted adenosines and 2-substituted adenosine 5'-carboxamides | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 1994-01-18 | — | — | US | disclosed |