Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ADH1B | P00325 | 3/20 | 0.42 |
| ▸ | ADH1A | P07327 | 3/20 | 0.42 |
| ▸ | ADH7 | P40394 | 3/20 | 0.42 |
| ▸ | ADH1C | P00326 | 2/20 | 0.42 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | ADH4 | P08319 | 1/20 | 0.41 |
| ▸ | MGAM | O43451 | 2/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.40 |
| ▸ | SI | P14410 | 2/20 | 0.40 |
| ▸ | MGAM2 | Q2M2H8 | 2/20 | 0.40 |
| ▸ | FAAH | O00519 | 2/20 | 0.35 |
| ▸ | NAAA | Q02083 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | HTR2C | P28335 | 1/20 | 0.31 |
| ▸ | ACHE | P22303 | 5/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL6320569 | 0.82 | ALDH1A1 (0.50) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL649327 | 0.80 | MGAM (0.55) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL16411225 | 0.80 | MGAM (0.55) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL2126561 | 0.79 | ADH1B (0.39) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL19384482 | 0.78 | ADH1B (0.44) | ADH1BADH1AADH7ADH1CEPHX1 | |
| SCHEMBL23041373 | 0.78 | MGAM (0.52) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL650012 | 0.78 | MGAM (0.52) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL6146968 | 0.78 | MGAM (0.52) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL4595426 | 0.78 | MGAM (0.52) | EPHX1MGAMGAASIMGAM2 | |
| SCHEMBL27474440 | 0.78 | MGAM (0.52) | EPHX1MGAMGAASIMGAM2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4994476-A | Hypotensive agents | BRISTOL-MYERS COMPANY (US) | 1991-02-19 | — | — | US | disclosed |
| EP-0201558-A4 | DIHYDROPYRIDIN-3,5-DICARBOXYLATES INCORPORATING ARYLOXYPROPANOLAMINE MOIETIES. | BRISTOL MYERS CO (US) | 1988-04-13 | — | — | EP | disclosed |
| EP-0201558-A1 | DIHYDROPYRIDIN-3,5-DICARBOXYLATES INCORPORATING ARYLOXYPROPANOLAMINE MOIETIES | Bristol-Myers Squibb Company (US) | 1986-11-20 | — | — | EP | disclosed |
| WO-1986002640-A1 | DIHYDROPYRIDIN-3,5-DICARBOXYLATES INCORPORATING ARYLOXYPROPANOLAMINE MOIETIES | BRISTOL-MYERS COMPANY (US) | 1986-05-09 | — | — | WO | disclosed |