Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.49 |
| ▸ | CXCR5 | P32302 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | AVPR1A | P37288 | 2/20 | 0.45 |
| ▸ | AVPR1B | P47901 | 1/20 | 0.45 |
| ▸ | HCRTR1 | O43613 | 5/20 | 0.43 |
| ▸ | HCRTR2 | O43614 | 5/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10137787 | 0.82 | ALDH1A1 (0.56) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL4529548 | 0.81 | ALDH1A1 (0.55) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL627877 | 0.79 | ALDH1A1 (0.59) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL6460843 | 0.79 | ALDH1A1 (0.59) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL503962 | 0.78 | ALDH1A1 (0.61) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL30393029 | 0.78 | ALDH1A1 (0.61) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL4539589 | 0.78 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL11671935 | 0.76 | ALDH1A1 (0.59) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| SCHEMBL13447246 | 0.76 | ALDH1A1 (0.59) | ALDH1A1LMNATSHRRAB9AHSD17B10 | |
| Hydrochloric Acid SCHEMBL1037379 | 0.76 | ALDH1A1 (0.60) | ALDH1A1LMNATSHRRAB9AHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002022137-A1 | β-LACTAM ANALOGS AND USES THEREFOR | SHOICHET BRIAN K (US) | 2002-03-21 | — | — | WO | disclosed |