Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 4/20 | 0.62 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | SLC6A4 | P31645 | 3/20 | 0.58 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | TAAR1 | Q96RJ0 | 3/20 | 0.55 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.55 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.55 |
| ▸ | KDM6B | O15054 | 1/20 | 0.54 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.51 |
| ▸ | LMNA | P02545 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | RAB9A | P51151 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30052034 | 1.00 | CYP3A4 (0.62) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL2457093 | 1.00 | CYP3A4 (0.62) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL8953616 | 1.00 | CYP3A4 (0.62) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL3350938 | 0.90 | KDM6B (0.54) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL3359174 | 0.90 | KDM6B (0.54) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL3350932 | 0.90 | KDM6B (0.54) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL7307051 | 0.87 | CYP3A4 (0.63) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL19369643 | 0.86 | CYP3A4 (0.60) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL4329251 | 0.85 | CYP3A4 (0.61) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 | |
| SCHEMBL14377906 | 0.85 | CYP3A4 (0.61) | CYP3A4CYP2D6SLC6A4ALDH1A1CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-103833546-B | The method of asymmetric synthesis of optical purity danshensu and its derivatives | XI'AN UNIVERSITY OF SCIENCE AND TECHNOLOGY (CN) | 2015-12-02 | — | — | CN | disclosed |
| CN-103833546-A | Asymmetric synthesis method of optically pure tanshinol and derivative of tanshinol | UNIV XI AN SCI & TECHNOLOGY | 2014-06-04 | — | — | CN | disclosed |
| EP-0634408-B1 | DEPSIPEPTIDE DERIVATIVE, PRODUCTION THEREOF AND USE THEREOF | FUJISAWA PHARMACEUTICAL CO (JP) | 2002-01-02 | — | — | EP | disclosed |
| US-5514773-A | PARASITICIDES, ANTHELMINTICS | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-05-07 | — | — | US | disclosed |
| EP-0634408-A1 | DEPSIPEPTIDE DERIVATIVE, PRODUCTION THEREOF AND USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1995-01-18 | — | — | EP | disclosed |