Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SRR | Q9GZT4 | 2/20 | 0.47 |
| ▸ | ALPI | P09923 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.47 |
| ▸ | XIAP | P98170 | 1/20 | 0.47 |
| ▸ | SLC7A5 | Q01650 | 1/20 | 0.47 |
| ▸ | MMP8 | P22894 | 1/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.43 |
| ▸ | SLC1A3 | P43003 | 1/20 | 0.43 |
| ▸ | SLC1A2 | P43004 | 1/20 | 0.43 |
| ▸ | SLC1A1 | P43005 | 1/20 | 0.43 |
| ▸ | LTA4H | P09960 | 1/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | CTRB1 | P17538 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL8583257 | 0.88 | ALPI (0.47) | SRRALPIPKMPTGS1XIAP | |
| SCHEMBL6929828 | 0.88 | ALDH1A1 (0.54) | SRRALPIPKMPTGS1XIAP | |
| SCHEMBL3425339 | 0.82 | ATM (0.51) | — | |
| SCHEMBL2336410 | 0.81 | SRR (0.55) | SRRALPIPKMPTGS1XIAP | |
| SCHEMBL180159 | 0.81 | KMT2A (0.55) | MMP8CYP1A2NPC1RAB9ALTA4H | |
| SCHEMBL3980617 | 0.81 | KMT2A (0.55) | MMP8CYP1A2NPC1RAB9ALTA4H | |
| SCHEMBL979240 | 0.81 | KMT2A (0.55) | MMP8CYP1A2NPC1RAB9ALTA4H | |
| SCHEMBL28260760 | 0.81 | EPHX1 (0.46) | SRRALPIPKMPTGS1XIAP | |
| Water SCHEMBL27509393 | 0.81 | CTSS (0.51) | — | |
| SCHEMBL6284464 | 0.80 | MMP8 (0.59) | PKMMMP8CYP1A2NPC1MEN1 |
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-1694660-A1 | PROCESS FOR THE PREPARATION OF ANHYDROUS AND HYDRATED ACTIVE PHARMACEUTICAL INGREDIENTS (APIS); STABLE PHARMACEUTICAL COMPOSITIONS PREPARED FROM THE SAME AND USES OF SAID COMPOSITIONS | Quiral Quimica Do Brasil (BR) | 2006-08-30 | — | — | EP | disclosed |
| WO-2005061474-A1 | PROCESS FOR THE PREPARATION OF ANHYDROUS AND HYDRATED ACTIVE PHARMACEUTICAL INGREDIENTS (APIS); STABLE PHARMACEUTICAL COMPOSITIONS PREPARED FROM THE SAME AND USES OF SAID COMPOSITIONS | QUIRAL QUÍMICA DO BRASIL (BR) | 2005-07-07 | — | — | WO | disclosed |