Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MGLL | Q99685 | 5/20 | 0.50 |
| ▸ | PTGS1 | P23219 | 3/20 | 0.50 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.50 |
| ▸ | FAAH | O00519 | 3/20 | 0.50 |
| ▸ | CES1 | P23141 | 2/20 | 0.43 |
| ▸ | CDC25A | P30304 | 2/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.41 |
| ▸ | ALDH3A1 | P30838 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 3/20 | 0.40 |
| ▸ | CNR1 | P21554 | 1/20 | 0.40 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
| ▸ | CA2 | P00918 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | G6PD | P11413 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18999087 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL8438883 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL4654369 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL8439722 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL187582 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL5970312 | 0.82 | MGLL (0.58) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL8439766 | 0.80 | MGLL (0.55) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL18212514 | 0.77 | ALDH1A1 (0.39) | MGLLALDH1A1KDM4ESMN1; SMN2HPGD | |
| SCHEMBL9064630 | 0.74 | MGLL (0.65) | MGLLPTGS1PTGS2FAAHCES1 | |
| SCHEMBL9064636 | 0.74 | MGLL (0.65) | MGLLPTGS1PTGS2FAAHCES1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017178828-A1 | CONJUGATES AND CONJUGATING REAGENTS COMPRISING A LINKER THAT INCLUDES AT LEAST TWO (-CH2-CH2-0-) UNITS IN A RING | POLYTHERICS LIMITED (GB) | 2017-10-19 | — | — | WO | disclosed |