Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRM1 | P35372 | 1/20 | 0.41 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | NOS2 | P35228 | 2/20 | 0.40 |
| ▸ | QPCT | Q16769 | 3/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | SMPD1 | P17405 | 3/20 | 0.38 |
| ▸ | BLM | P54132 | 1/20 | 0.38 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8828256 | 0.98 | OPRM1 (0.43) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL9233122 | 0.89 | OPRM1 (0.42) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL9162027 | 0.87 | OPRM1 (0.41) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL8828195 | 0.86 | OPRM1 (0.44) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL8828422 | 0.85 | OPRM1 (0.43) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL8828231 | 0.84 | OPRM1 (0.44) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL9162212 | 0.84 | NOS2 (0.40) | OPRM1TMEM97SIGMAR1NOS2QPCT | |
| SCHEMBL9160192 | 0.83 | CYP3A4 (0.38) | OPRM1TMEM97SIGMAR1POLBCYP3A4 | |
| SCHEMBL9160628 | 0.82 | MAOB (0.38) | OPRM1TMEM97SIGMAR1NOS2 | |
| SCHEMBL8828419 | 0.79 | MAOB (0.38) | OPRM1TMEM97SIGMAR1KDM4EMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5430059-A | Treating heart disease | EISAI CO., LTD. (JP) | 1995-07-04 | — | — | US | disclosed |
| EP-0633248-A1 | Butenoic acid derivatives | Eisai Co., Ltd. (JP) | 1995-01-11 | — | — | EP | disclosed |
| EP-0589491-A1 | Butenoic acid derivatives | Eisai Co., Ltd. (JP) | 1994-03-30 | — | — | EP | disclosed |
| US-5292770-A | Butenoic acid derivatives | EISAI CO., LTD. (JP) | 1994-03-08 | — | — | US | disclosed |
| US-5166188-A | Cardiovascular disorders, antiischemic agents | EISAI CO., LTD. (JP) | 1992-11-24 | — | — | US | disclosed |