Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CALM1 | P0DP23 | 1/20 | 0.44 |
| ▸ | GAA | P10253 | 3/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.37 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL23567082 | 0.82 | MAOA (0.39) | GAALMNASMN1; SMN2HPGDTDP1 | |
| SCHEMBL27174207 | 0.76 | TP53 (0.43) | CALM1GAALMNACYP2C19CYP3A4 | |
| SCHEMBL27697223 | 0.75 | BCL2 (0.47) | CALM1CYP3A4HPGDMEN1KMT2A | |
| SCHEMBL6751023 | 0.75 | CALM1 (0.44) | CALM1CYP3A4NPC1RAB9ASMN1; SMN2 | |
| SCHEMBL28145090 | 0.75 | CALM1 (0.44) | CALM1NPC1RAB9AHPGDTDP1 | |
| SCHEMBL25349664 | 0.75 | GAA (0.45) | CALM1GAALMNACYP2C19CYP3A4 | |
| SCHEMBL10766018 | 0.72 | TP53 (0.43) | CALM1MEN1KMT2ALTA4HTP53 | |
| SCHEMBL11397773 | 0.71 | TP53 (0.50) | GAACYP2C19CYP3A4CYP2C9SMN1; SMN2 | |
| SCHEMBL11400583 | 0.70 | TSHR (0.53) | CYP2C19CYP3A4CYP2C9RAB9ASMN1; SMN2 | |
| SCHEMBL15324600 | 0.69 | GAA (0.59) | GAALMNACYP2C19CYP3A4CYP2C9 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1603897-A1 | PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION | Biolipox AB (SE) | 2005-12-14 | — | — | EP | disclosed |
| WO-2004080999-A1 | PYRAZOLE COMPOUNDS USEFUL IN THE TREATMENT OF INFLAMMATION | BIOLIPOX AB (SE) | 2004-09-23 | — | — | WO | disclosed |
| EP-0371390-A2 | Amino acid derivatives | MERCK PATENT GmbH (DE) | 1990-06-06 | — | — | EP | disclosed |