Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 3/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.33 |
| ▸ | MAPT | P10636 | 5/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.33 |
| ▸ | HTT | P42858 | 2/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.33 |
| ▸ | GLA | P06280 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.32 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9316278 | 1.00 | CYP2D6 (0.35) | CYP2D6CYP3A4CYP2C19ALDH1A1MAPT | |
| SCHEMBL27593238 | 0.73 | MEN1 (0.44) | CYP2D6ALDH1A1MAPTLMNACYP2C9 | |
| SCHEMBL20428224 | 0.67 | GAA (0.33) | GAA | |
| SCHEMBL8466246 | 0.67 | ADCY2 (0.30) | — | |
| SCHEMBL11473105 | 0.67 | ALDH1A1 (0.39) | ALDH1A1MAPTLMNAHTTCYP2C9 | |
| SCHEMBL638075 | 0.65 | MAPT (0.36) | CYP2C19ALDH1A1MAPTLMNAHTT | |
| SCHEMBL21877489 | 0.63 | ALDH1A1 (0.60) | CYP2D6CYP3A4CYP2C19ALDH1A1MAPT | |
| SCHEMBL4466511 | 0.62 | MAOB (0.41) | CYP3A4CYP2C19ALDH1A1MAPTLMNA | |
| SCHEMBL14159845 | 0.62 | LMNA (0.42) | CYP2D6CYP3A4CYP2C19ALDH1A1MAPT | |
| SCHEMBL8007148 | 0.61 | OPRM1 (0.38) | CYP2D6ALDH1A1CYP2C9MEN1KMT2A |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0523151-B1 | TRANSMETALATIONS FROM ZIRCONIUM TO COPPER INTERMEDIATES | UNIV CALIFORNIA (US) | 1994-12-28 | — | — | EP | disclosed |
| US-5286889-A | Reacting 1-alkyne with zirconocene chloride hydride, reacting product with organic lithium compound, reacting with lithium cuprate compound | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1994-02-15 | — | — | US | disclosed |
| EP-0523151-A1 | TRANSMETALATIONS FROM ZIRCONIUM TO COPPER INTERMEDIATES. | UNIV CALIFORNIA (US) | 1993-01-20 | — | — | EP | disclosed |
| US-5166382-A | Complexing to produce intermediates in preparation of vinylic side chains | REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1992-11-24 | — | — | US | disclosed |
| US-5072010-A | Reacting zirconium and lithium compounds, reacting product with copper/lithium complex | UNIVERSITY OF CALIFORNIA (US) | 1991-12-10 | — | — | US | disclosed |
| WO-1991015493-A1 | TRANSMETALATIONS FROM ZIRCONIUM TO COPPER INTERMEDIATES | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 1991-10-17 | — | — | WO | disclosed |