Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CAPN1 | P07384 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | PRMT1 | Q99873 | 1/20 | 0.40 |
| ▸ | FFAR1 | O14842 | 3/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 1/20 | 0.35 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.34 |
| ▸ | MMP12 | P39900 | 1/20 | 0.34 |
| ▸ | GMNN | O75496 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.34 |
| ▸ | THPO | P40225 | 1/20 | 0.34 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.34 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.34 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL725811 | 0.80 | MAPT (0.32) | ALDH1A1MAPTTSHRPMP22ALOX5 | |
| SCHEMBL6680643 | 0.79 | HRH3 (0.50) | LMNAAOC3 | |
| SCHEMBL3428503 | 0.78 | ALDH1A1 (0.51) | ALDH1A1LMNACA2MAPTHIF1A | |
| SCHEMBL6833465 | 0.76 | CA2 (0.48) | ALDH1A1LMNAFFAR1CA2MAPT | |
| SCHEMBL22504113 | 0.75 | AOC3 (0.58) | CAPN1ALDH1A1LMNAMAPTTSHR | |
| SCHEMBL3615251 | 0.72 | ALDH1A1 (0.41) | ALDH1A1LMNACYP2D6MAPTTSHR | |
| SCHEMBL3606664 | 0.72 | CA2 (0.40) | ALDH1A1LMNACA2CA1GMNN | |
| SCHEMBL987884 | 0.72 | GFER (0.56) | CAPN1ALDH1A1LMNAPRMT1FFAR1 | |
| SCHEMBL4667379 | 0.72 | CAPN1 (0.52) | CAPN1ALDH1A1LMNAPRMT1FFAR1 | |
| SCHEMBL18586398 | 0.72 | CAPN1 (0.52) | CAPN1ALDH1A1LMNAPRMT1FFAR1 |
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-20020028469-A1 | Method of defining genus of chemical compound and method of designing molecules | BURCH RONALD M (US) | 2002-03-07 | — | — | US | disclosed |