Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | GAA | P10253 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | MMP13 | P45452 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 1/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.51 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | NAMPT | P43490 | 1/20 | 0.51 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.50 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL6929919 | 0.83 | RECQL (0.62) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| SCHEMBL21065527 | 0.83 | HTT (0.68) | ALDH1A1MAPTGAAHSD17B10HTT | |
| SCHEMBL29783179 | 0.83 | RAB9A (0.73) | ALDH1A1MAPTGAAHSD17B10HTT | |
| Iodide SCHEMBL20524285 | 0.82 | RECQL (0.61) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| SCHEMBL10405358 | 0.81 | ALDH1A1 (0.58) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| SCHEMBL30437853 | 0.81 | GAA (0.64) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| SCHEMBL334662 | 0.81 | GAA (0.64) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| SCHEMBL48578 | 0.79 | HTT (0.64) | ALDH1A1MAPTGAAHSD17B10HTT | |
| SCHEMBL20825050 | 0.79 | ALDH1A1 (0.56) | ALDH1A1MAPTGAAHSD17B10MMP13 | |
| Hydrochloric Acid SCHEMBL7601454 | 0.79 | GAA (0.62) | ALDH1A1MAPTGAAHSD17B10MMP13 |
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-1147079-A2 | BETA-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | Bayer Aktiengesellschaft (DE) | 2001-10-24 | — | — | EP | disclosed |
| WO-2000041469-A2 | β-PHENYLALANINE DERIVATIVES AS INTEGRIN ANTAGONISTS | BAYER AKTIENGESELLSCHAFT (DE) | 2000-07-20 | — | — | WO | disclosed |