Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C19 | P33261 | 5/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.43 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | POLB | P06746 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | ATM | Q13315 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 3/20 | 0.36 |
| ▸ | F10 | P00742 | 1/20 | 0.35 |
| ▸ | OPRD1 | P41143 | 2/20 | 0.35 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.35 |
| ▸ | SLC22A1 | O15245 | 1/20 | 0.35 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.35 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.35 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12083378 | 0.79 | CYP2C19 (0.39) | CYP2C19CYP3A4SMN1; SMN2CYP2C9TSHR | |
| SCHEMBL4812312 | 0.79 | CYP2C19 (0.43) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL4812087 | 0.77 | CYP2C19 (0.42) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL4152272 | 0.77 | CYP2C19 (0.42) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL28255942 | 0.77 | CYP2C19 (0.45) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL28544353 | 0.77 | CYP2C19 (0.42) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL11720220 | 0.76 | ATM (0.43) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL1577155 | 0.75 | ATM (0.45) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL4811574 | 0.75 | CYP2C19 (0.41) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 | |
| SCHEMBL21244563 | 0.75 | CYP2C19 (0.41) | CYP2C19CYP3A4SMN1; SMN2POLBALDH1A1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0941231-B1 | Heteroarylic-arylic diphosphines as chiral ligands | CHEMI SPA (IT) | 2003-05-02 | — | — | EP | disclosed |
| US-6153758-A | Heteroarylic-arylic diphosphines as chiral ligands | CHEMI S.P.A. (IT) | 2000-11-28 | — | — | US | disclosed |
| EP-0941231-A1 | HETEROARYLIC-ARYLIC DIPHOSPHINES AS CHIRAL LIGANDS | CHEMI S.p.A. (IT) | 1999-09-15 | — | — | EP | disclosed |
| WO-1998022484-A1 | HETEROARYLIC-ARYLIC DIPHOSPHINES AS CHIRAL LIGANDS | CHEMI S.P.A. (IT) | 1998-05-28 | — | — | WO | disclosed |