Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACLY | P53396 | 5/20 | 0.41 |
| ▸ | SCN9A | Q15858 | 2/20 | 0.40 |
| ▸ | PI4KB | Q9UBF8 | 5/20 | 0.38 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.38 |
| ▸ | TUBB | P07437 | 1/20 | 0.38 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.38 |
| ▸ | STAT3 | P40763 | 1/20 | 0.38 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.38 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.38 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.38 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.38 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.38 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.38 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.38 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.38 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.38 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.38 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.38 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.38 |
| ▸ | KDM1A | O60341 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8635601 | 0.90 | ACLY (0.46) | ACLYSCN9API4KBTUBB4ATUBB | |
| SCHEMBL8629945 | 0.89 | ACLY (0.43) | ACLYSCN9API4KBTUBB4ATUBB | |
| SCHEMBL8634518 | 0.88 | PI4KB (0.42) | ACLYSCN9API4KBTUBB4ATUBB | |
| SCHEMBL8635028 | 0.88 | PI4KB (0.40) | ACLYPI4KBKDM1APTGS2PTGS1 | |
| SCHEMBL8634716 | 0.86 | PI4KB (0.42) | ACLYSCN9API4KBTUBB4ATUBB | |
| SCHEMBL8628869 | 0.85 | PTGS2 (0.38) | ACLYPI4KBPTGS2PTGS1EDNRA | |
| SCHEMBL8631761 | 0.85 | PTGS2 (0.44) | ACLYPI4KBPTGS2PTGS1EDNRA | |
| SCHEMBL8627805 | 0.85 | PI4KB (0.38) | ACLYPI4KBSTAT3PTGS2PTGS1 | |
| SCHEMBL8632815 | 0.84 | PTGS2 (0.38) | ACLYPI4KBPTGS2PTGS1EDNRA | |
| SCHEMBL8627617 | 0.83 | SMN1; SMN2 (0.42) | — |
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-5756530-A | NON-STEROIDAL ANTIINFLAMMATORY AGENTS WITH REDUCED SIDE EFFECTS | G. D. SEARLE & CO. (US) | 1998-05-26 | — | — | US | disclosed |