Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CPA1 | P15085 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MMP9 | P14780 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11414624 | 0.85 | ALDH1A1 (0.39) | CPA1ALDH1A1 | |
| SCHEMBL28195500 | 0.83 | — | — | |
| SCHEMBL1170239 | 0.79 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL2801476 | 0.76 | — | — | |
| SCHEMBL1118146 | 0.75 | — | — | |
| SCHEMBL28141644 | 0.75 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL27686258 | 0.73 | ALDH1A1 (0.38) | ALDH1A1 | |
| SCHEMBL10402405 | 0.72 | CPA1 (0.35) | CPA1 | |
| SCHEMBL1151111 | 0.71 | ALDH1A1 (0.42) | ALDH1A1 | |
| SCHEMBL27709392 | 0.71 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-3118361-A | — | — | None | — | — | JP | disclosed |
| WO-2015106443-A1 | PREPARATION AND APPLICATION OF BIPHENYL COMPOUND | 迈克斯(如东)化工有限公司 | 2015-07-23 | — | — | WO | disclosed |
| EP-2276756-B9 | HYDROXYMETHYL PYRROLIDINES AS BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME (US) | 2012-08-15 | — | — | EP | disclosed |
| EP-2276756-B1 | HYDROXYMETHYL PYRROLIDINES AS BETA 3 ADRENERGIC RECEPTOR AGONISTS | MERCK SHARP & DOHME (US) | 2011-11-30 | — | — | EP | disclosed |
| US-5444083-A | DOPAMINE AGONIST FOR TREATING OR PREVENTION OF HYPERTENSION OR HEART FAILURE | EISAI CO., LTD. (JP) | 1995-08-22 | — | — | US | disclosed |
| EP-0381235-B1 | PYRROLIDINE COMPOUND AND PHARMACEUTICAL USE | Eisai Co., Ltd. (JP) | 1993-07-28 | — | — | EP | disclosed |
| JP-H03118361-A | PYRROLIDINE DERIVATIVE | EISAI CO LTD | 1991-05-20 | — | — | JP | disclosed |
| EP-0381235-A2 | Pyrrolidine compound and pharmaceutical use | Eisai Co., Ltd. (JP) | 1990-08-08 | — | — | EP | disclosed |