Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A2 | O94788 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | ALDH2 | P05091 | 1/20 | 0.50 |
| ▸ | ALDH1A3 | P47895 | 1/20 | 0.50 |
| ▸ | DPP7 | Q9UHL4 | 2/20 | 0.48 |
| ▸ | EPHX1 | P07099 | 4/20 | 0.48 |
| ▸ | ACHE | P22303 | 7/20 | 0.45 |
| ▸ | MMP2 | P08253 | 1/20 | 0.45 |
| ▸ | NAAA | Q02083 | 2/20 | 0.45 |
| ▸ | RRM1 | P23921 | 1/20 | 0.44 |
| ▸ | GNAI3 | P08754 | 1/20 | 0.42 |
| ▸ | GNAO1 | P09471 | 1/20 | 0.42 |
| ▸ | GNAI1 | P63096 | 1/20 | 0.42 |
| ▸ | MMP8 | P22894 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9351242 | 0.83 | ALDH1A2 (0.50) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL14602764 | 0.82 | MEN1 (0.56) | ALDH1A1DPP7EPHX1ACHEMMP2 | |
| SCHEMBL9548562 | 0.82 | MEN1 (0.56) | ALDH1A1DPP7EPHX1ACHEMMP2 | |
| SCHEMBL8815679 | 0.80 | MEN1 (0.55) | DPP7EPHX1ACHEMMP2NAAA | |
| SCHEMBL8926651 | 0.79 | ALDH1A2 (0.47) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL9157273 | 0.78 | DPP7 (0.48) | ALDH1A1DPP7EPHX1ACHEMMP2 | |
| SCHEMBL224484 | 0.77 | EPHX1 (0.52) | DPP7EPHX1ACHEMMP2RRM1 | |
| SCHEMBL9116536 | 0.77 | ALDH1A1 (0.58) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 | |
| SCHEMBL6943898 | 0.77 | DPP7 (0.52) | DPP7EPHX1ACHEMMP2NAAA | |
| SCHEMBL11066731 | 0.77 | DPP7 (0.56) | ALDH1A2ALDH1A1ALDH2ALDH1A3DPP7 |
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-0885215-A1 | NOVEL BENZO-1,3-DIOXOLYL- AND BENZOFURANYL SUBSTITUTED PYRROLIDINE DERIVATIVES AS ENDOTHELIN ANTAGONISTS | Abbott Laboratories (US) | 1998-12-23 | — | — | EP | disclosed |
| WO-1997030045-A1 | NOVEL BENZO-1,3-DIOXOLYL- AND BENZOFURANYL SUBSTITUTED PYRROLIDINE DERIVATIVES AS ENDOTHELIN ANTAGONISTS | ABBOTT LABORATORIES (US) | 1997-08-21 | — | — | WO | disclosed |