Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES1 | P23141 | 8/20 | 0.45 |
| ▸ | FAAH | O00519 | 5/20 | 0.45 |
| ▸ | CES2 | O00748 | 4/20 | 0.45 |
| ▸ | CA2 | P00918 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | S1PR2 | O95136 | 1/20 | 0.42 |
| ▸ | S1PR4 | O95977 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | XBP1 | P17861 | 1/20 | 0.42 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.42 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.42 |
| ▸ | AGTR1 | P30556 | 1/20 | 0.42 |
| ▸ | HTT | P42858 | 1/20 | 0.42 |
| ▸ | RAB9A | P51151 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL52570 | 0.88 | CA2 (0.52) | CES1FAAHCES2CA2ALDH1A1 | |
| Alcohol SCHEMBL8778843 | 0.86 | CA2 (0.46) | CES1FAAHCES2CA2ALDH1A1 | |
| Butane SCHEMBL28212406 | 0.85 | CA2 (0.50) | CES1FAAHCES2CA2ALDH1A1 | |
| Fluoride SCHEMBL27308674 | 0.85 | CA2 (0.50) | CES1FAAHCES2CA2ALDH1A1 | |
| SCHEMBL28606255 | 0.85 | CA2 (0.50) | CES1FAAHCES2CA2ALDH1A1 | |
| Water SCHEMBL27573237 | 0.85 | CA2 (0.50) | CES1FAAHCES2CA2ALDH1A1 | |
| Propanol SCHEMBL8778756 | 0.83 | ALDH1A1 (0.45) | CES1FAAHCES2CA2ALDH1A1 | |
| SCHEMBL6865751 | 0.82 | CA2 (0.61) | CES1FAAHCES2CA2ALDH1A1 | |
| SCHEMBL1419242 | 0.82 | CA2 (0.48) | CES1FAAHCES2CA2ALDH1A1 | |
| Hydrochloric Acid SCHEMBL27819419 | 0.82 | CA2 (0.48) | CES1FAAHCES2CA2ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0351182-B1 | INK OCCLUSION MATERIAL FOR WRITING UTENSILS | KANEBO LTD. (JP) | 1993-09-15 | — | — | EP | disclosed |
| EP-0351182-A2 | Ink occlusion material for writing utensils | KANEBO LTD. (JP) | 1990-01-17 | — | — | EP | disclosed |