Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.52 |
| ▸ | BCL2 | P10415 | 1/20 | 0.48 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.48 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | DRD2 | P14416 | 1/20 | 0.39 |
| ▸ | DRD1 | P21728 | 1/20 | 0.39 |
| ▸ | DRD4 | P21917 | 1/20 | 0.39 |
| ▸ | DRD5 | P21918 | 1/20 | 0.39 |
| ▸ | HRH1 | P35367 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL972711 | 0.87 | CALM1 (0.69) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL5598862 | 0.81 | HSPA5 (0.38) | CALM1HIF1A | |
| SCHEMBL5158250 | 0.78 | LTA4H (0.60) | SMN1; SMN2MEN1KMT2AL3MBTL1 | |
| SCHEMBL14037003 | 0.77 | HTR2A (0.58) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL3244924 | 0.75 | HTR2A (0.56) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL3821433 | 0.75 | HTR2A (0.56) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL1773099 | 0.75 | HTR2A (0.56) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL6548117 | 0.75 | HTR2A (0.56) | HTR2ACALM1BCL2BCL2L1DRD2 | |
| SCHEMBL695542 | 0.75 | HTR2A (0.56) | HTR2ACALM1BCL2BCL2L1ALOX5 | |
| SCHEMBL1238833 | 0.75 | HTR2A (0.68) | HTR2ACALM1BCL2BCL2L1ALOX5 |
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 |
|---|---|---|---|---|---|---|---|
| US-4237072-A | HYDROGENATION IN THE PRESENCE OF A RHODIUM CHIRAL PHOSPHINE COMPLEX FORMED IN SITU | RHONE-POULENC INDUSTRIES (FR) | 1980-12-02 | — | — | US | disclosed |
| EP-0000315-B1 | PROCESS FOR PREPARING OPTICALLY ACTIVE CITRONELLAL | RHONE-POULENC INDUSTRIES (FR) | 1980-09-17 | — | — | EP | disclosed |
| EP-0000315-A1 | Process for preparing optically active citronellal | RHONE-POULENC INDUSTRIES (FR) | 1979-01-10 | — | — | EP | disclosed |