Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 8/20 | 0.40 |
| ▸ | NPC1 | O15118 | 7/20 | 0.40 |
| ▸ | AR | P10275 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 6/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.40 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.40 |
| ▸ | RELA | Q04206 | 1/20 | 0.40 |
| ▸ | MEN1 | O00255 | 5/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | GAA | P10253 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | GMNN | O75496 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL600247 | 0.80 | RAB9A (0.36) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL600246 | 0.80 | RAB9A (0.36) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL399673 | 0.79 | ALDH1A1 (0.49) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL694714 | 0.76 | RAB9A (0.45) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL694716 | 0.76 | RAB9A (0.45) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL10039876 | 0.74 | RAB9A (0.55) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL398766 | 0.73 | KDM4E (0.55) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL6237278 | 0.72 | RAB9A (0.52) | RAB9ANPC1ARCYP3A4CYP1A2 | |
| SCHEMBL13712387 | 0.70 | ALDH1A1 (0.64) | SMN1; SMN2KDM4EALDH1A1RELAMEN1 | |
| SCHEMBL15356385 | 0.70 | ALDH1A1 (0.64) | SMN1; SMN2KDM4EALDH1A1RELAMEN1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2421837-A1 | PREPARATION OF C-PYRAZINE-METHYLAMINES | OSI Pharmaceuticals, LLC (US) | 2012-02-29 | — | — | EP | disclosed |
| WO-2010123792-A1 | PREPARATION OF C-PYRAZINE-METHYLAMINES | OSI PHARMACEUTICALS, INC. (US) | 2010-10-28 | — | — | WO | disclosed |