Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | POLB | P06746 | 2/20 | 0.40 |
| ▸ | ALPL | P05186 | 1/20 | 0.35 |
| ▸ | CYP17A1 | P05093 | 2/20 | 0.35 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.34 |
| ▸ | TUBB | P07437 | 1/20 | 0.34 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.34 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.34 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.34 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.34 |
| ▸ | TUBB3 | Q13509 | 1/20 | 0.34 |
| ▸ | TUBB2A | Q13885 | 1/20 | 0.34 |
| ▸ | TUBB8 | Q3ZCM7 | 1/20 | 0.34 |
| ▸ | TUBA3E | Q6PEY2 | 1/20 | 0.34 |
| ▸ | TUBA1A | Q71U36 | 1/20 | 0.34 |
| ▸ | TUBA1C | Q9BQE3 | 1/20 | 0.34 |
| ▸ | TUBB6 | Q9BUF5 | 1/20 | 0.34 |
| ▸ | TUBB2B | Q9BVA1 | 1/20 | 0.34 |
| ▸ | TUBB1 | Q9H4B7 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 3/20 | 0.33 |
| ▸ | NFE2L2 | Q16236 | 2/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL25189031 | 1.00 | POLB (0.40) | POLBALPLCYP17A1TUBB4ATUBB | |
| SCHEMBL25193028 | 0.89 | CHRNB4 (0.37) | POLBCYP17A1ERN1NFE2L2HTT | |
| SCHEMBL31019973 | 0.89 | CHRNB4 (0.37) | POLBCYP17A1ERN1NFE2L2HTT | |
| SCHEMBL31019964 | 0.88 | POLB (0.35) | POLBALPLCYP17A1ERN1NFE2L2 | |
| SCHEMBL25187642 | 0.88 | POLB (0.35) | POLBALPLCYP17A1ERN1NFE2L2 | |
| SCHEMBL30963578 | 0.87 | MEN1 (0.40) | POLBNFE2L2KMT2APTGS1PTGS2 | |
| SCHEMBL19385625 | 0.87 | MEN1 (0.40) | POLBNFE2L2KMT2APTGS1PTGS2 | |
| SCHEMBL26651006 | 0.86 | PTGS2 (0.36) | POLBHTTKMT2APTGS1PTGS2 | |
| SCHEMBL30287361 | 0.86 | PTGS2 (0.36) | POLBHTTKMT2APTGS1PTGS2 | |
| SCHEMBL28996379 | 0.85 | ERN1 (0.41) | POLBERN1HTTKMT2APTGS1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-118451060-A | Pyrrole derivative or pharmaceutically acceptable salt thereof and composition for preventing, improving or treating gastrointestinal diseases comprising the same as active ingredient | 合娜制药株式会社 | 2024-08-06 | — | — | CN | disclosed |