Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | CA1 | P00915 | 3/20 | 0.56 |
| ▸ | CA2 | P00918 | 3/20 | 0.56 |
| ▸ | CA7 | P43166 | 3/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.55 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.55 |
| ▸ | GAA | P10253 | 3/20 | 0.52 |
| ▸ | MAPT | P10636 | 2/20 | 0.52 |
| ▸ | ALPL | P05186 | 1/20 | 0.52 |
| ▸ | ALPG | P10696 | 1/20 | 0.52 |
| ▸ | CA9 | Q16790 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.51 |
| ▸ | MEN1 | O00255 | 5/20 | 0.51 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.50 |
| ▸ | USP2 | O75604 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.48 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL7430239 | 0.79 | CA1 (0.65) | CYP2C19CA1CA2CA7ALDH1A1 | |
| Hydrochloric Acid SCHEMBL7432666 | 0.78 | CA1 (0.64) | CYP2C19CA1CA2CA7ALDH1A1 | |
| SCHEMBL3833776 | 0.77 | CYP2C19 (0.60) | CYP2C19ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3393276 | 0.76 | SLC27A1 (0.74) | CA1CA2CA7ALDH1A1KDM4E | |
| SCHEMBL30585259 | 0.76 | ALDH1A1 (0.73) | CYP2C19ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL29078430 | 0.76 | ALDH1A1 (0.73) | CYP2C19ALDH1A1KDM4EGAAMAPT | |
| SCHEMBL3395419 | 0.75 | CA1 (0.52) | CA1CA2CA7ALDH1A1KDM4E | |
| SCHEMBL23086156 | 0.75 | MEN1 (0.60) | CA1CA2CA7ALDH1A1KDM4E | |
| SCHEMBL7423903 | 0.73 | ALOX15 (0.60) | CA1CA2CA7ALDH1A1GAA | |
| SCHEMBL31611860 | 0.73 | CYP2C19 (0.73) | CYP2C19ALDH1A1KDM4EGAAMAPT |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0283310-B1 | N-BENZHYDRYL-SUBSTITUTED HETEROCYCLIC DERIVATIVES, THEIR PREPARATION AND THEIR USE | Sankyo Company Limited (JP) | 1993-05-26 | — | — | EP | disclosed |
| US-5028610-A | Calcium Channel Blockers | SANKYO COMPANY LIMITED (JP) | 1991-07-02 | — | — | US | disclosed |
| EP-0283310-A1 | N-Benzhydryl-substituted heterocyclic derivatives, their preparation and their use | Sankyo Company Limited (JP) | 1988-09-21 | — | — | EP | disclosed |