Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA12 | O43570 | 2/20 | 0.35 |
| ▸ | CA1 | P00915 | 2/20 | 0.35 |
| ▸ | CA9 | Q16790 | 2/20 | 0.35 |
| ▸ | EGFR | P00533 | 1/20 | 0.34 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | MMP1 | P03956 | 1/20 | 0.33 |
| ▸ | MMP2 | P08253 | 1/20 | 0.33 |
| ▸ | MMP3 | P08254 | 1/20 | 0.33 |
| ▸ | MMP8 | P22894 | 1/20 | 0.33 |
| ▸ | ATM | Q13315 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14229154 | 0.89 | CA12 (0.38) | CA12CA1CA9ALDH1A1MMP1 | |
| SCHEMBL14229674 | 0.84 | CA12 (0.39) | CA12CA1CA9ALDH1A1MMP1 | |
| SCHEMBL14228912 | 0.84 | CA12 (0.44) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL14200283 | 0.81 | — | — | |
| SCHEMBL14229504 | 0.81 | CA12 (0.41) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL2478022 | 0.81 | EGFR (0.42) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL14230105 | 0.76 | CA12 (0.37) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL14229673 | 0.76 | MMP1 (0.39) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL14229113 | 0.75 | CA1 (0.36) | CA12CA1CA9EGFRERBB2 | |
| SCHEMBL14200269 | 0.75 | CA12 (0.36) | CA12CA1CA9EGFRERBB2 |
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 |