Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 1/20 | 0.36 |
| ▸ | CA2 | P00918 | 1/20 | 0.36 |
| ▸ | CA9 | Q16790 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | MLYCD | O95822 | 1/20 | 0.33 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | CYP4F2 | P78329 | 1/20 | 0.33 |
| ▸ | CYP4A11 | Q02928 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | APP | P05067 | 1/20 | 0.31 |
| ▸ | MGAM | O43451 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | SI | P14410 | 1/20 | 0.31 |
| ▸ | MGAM2 | Q2M2H8 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL13633145 | 0.94 | ALDH1A1 (0.37) | ALDH1A1TRPA1CYP4F2CYP4A11LMNA | |
| SCHEMBL14201257 | 0.89 | CA12 (0.40) | CA12CA2CA9ALDH1A1TRPA1 | |
| SCHEMBL14200244 | 0.87 | ALDH1A1 (0.34) | ALDH1A1TSHRTRPA1CYP4F2CYP4A11 | |
| SCHEMBL10087947 | 0.86 | CA12 (0.46) | CA12CA2CA9ALDH1A1HPGD | |
| SCHEMBL14200277 | 0.85 | ALDH1A1 (0.33) | ALDH1A1TRPA1CYP4F2CYP4A11LMNA | |
| Hydrochloric Acid SCHEMBL28190002 | 0.84 | CA12 (0.44) | CA12CA2CA9ALDH1A1HPGD | |
| SCHEMBL14873475 | 0.83 | CA12 (0.38) | CA12CA2CA9ALDH1A1HPGD | |
| SCHEMBL14200266 | 0.83 | CA12 (0.32) | CA12CA2CA9TSHRMAPK1 | |
| SCHEMBL14200286 | 0.83 | TSHR (0.33) | CA12CA2CA9ALDH1A1TSHR | |
| SCHEMBL14200284 | 0.83 | MMP8 (0.34) | ALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7365093-B2 | Endothelin antagonists | ABBOTT LABORATORIES (US) | 2008-04-29 | — | — | US | disclosed |
| US-7208517-B1 | Endothelin antagonists | ABBOTT LABORTORIES (US) | 2007-04-24 | — | — | US | disclosed |