Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAOA | P21397 | 1/20 | 0.38 |
| ▸ | KMO | O15229 | 1/20 | 0.37 |
| ▸ | PTGER1 | P34995 | 1/20 | 0.37 |
| ▸ | PTGER4 | P35408 | 1/20 | 0.37 |
| ▸ | PTGER3 | P43115 | 1/20 | 0.37 |
| ▸ | PTGER2 | P43116 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 2/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.34 |
| ▸ | ESR1 | P03372 | 1/20 | 0.34 |
| ▸ | MGLL | Q99685 | 1/20 | 0.34 |
| ▸ | ACMSD | Q8TDX5 | 1/20 | 0.33 |
| ▸ | GP6 | Q9HCN6 | 1/20 | 0.33 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.33 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.33 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.33 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.33 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL445102 | 0.88 | ALDH1A1 (0.41) | BACE1ALDH1A1MEN1KMT2AMGLL | |
| SCHEMBL27629739 | 0.88 | ALDH1A1 (0.41) | BACE1ALDH1A1MEN1KMT2AMGLL | |
| SCHEMBL6880077 | 0.88 | ALDH1A1 (0.41) | BACE1ALDH1A1MEN1KMT2AMGLL | |
| SCHEMBL618853 | 0.88 | BACE1 (0.39) | BACE1ALDH1A1HDAC4HDAC2HDAC8 | |
| SCHEMBL3870533 | 0.84 | BACE1 (0.36) | BACE1ALDH1A1HDAC4HDAC2HDAC8 | |
| SCHEMBL6474583 | 0.84 | BACE1 (0.36) | BACE1ALDH1A1HDAC4HDAC2HDAC8 | |
| SCHEMBL28592015 | 0.80 | GSTP1 (0.47) | ALDH1A1MEN1KMT2AESR1ACMSD | |
| SCHEMBL28596706 | 0.80 | GSTP1 (0.47) | ALDH1A1MEN1KMT2AESR1ACMSD | |
| SCHEMBL18832483 | 0.79 | ALDH1A1 (0.39) | BACE1ALDH1A1MEN1KMT2AMGLL | |
| SCHEMBL30459454 | 0.79 | ALDH1A1 (0.50) | MAOAKMOPTGER1PTGER4PTGER3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0976748-B1 | PYRROLIDINE DERIVATIVES HAVING PHOSPHOLIPASE A2 INHIBITORY ACTIVITY | SHIONOGI & CO (JP) | 2003-12-03 | — | — | EP | disclosed |