Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.41 |
| ▸ | CYP19A1 | P11511 | 5/20 | 0.40 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.40 |
| ▸ | NAAA | Q02083 | 1/20 | 0.39 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | APOBEC3A | P31941 | 1/20 | 0.38 |
| ▸ | APOBEC3G | Q9HC16 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | LPAR1 | Q92633 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | GLS | O94925 | 2/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL7752548 | 1.00 | ALDH1A1 (0.43) | ALDH1A1CYP3A4POLBCYP19A1HSD17B10 | |
| SCHEMBL5184706 | 0.79 | POLB (0.45) | POLBNAAA | |
| SCHEMBL1202828 | 0.78 | ALDH1A1 (0.58) | ALDH1A1CYP3A4HSD17B10PABPC1APOBEC3A | |
| SCHEMBL17844445 | 0.76 | CYP2D6 (0.38) | CYP3A4POLBCYP19A1NAAATSHR | |
| SCHEMBL11130696 | 0.76 | ALDH1A1 (0.49) | ALDH1A1CYP3A4CYP19A1HSD17B10PABPC1 | |
| SCHEMBL3801806 | 0.75 | SIGMAR1 (0.41) | TSHR | |
| Hydrazine SCHEMBL18138498 | 0.75 | ALDH1A1 (0.55) | ALDH1A1CYP3A4POLBHSD17B10PABPC1 | |
| Bromide SCHEMBL10735522 | 0.74 | ALDH1A1 (0.47) | ALDH1A1CYP3A4CYP19A1HSD17B10PABPC1 | |
| SCHEMBL5184701 | 0.74 | POLB (0.39) | ALDH1A1POLBLPAR1MEN1KMT2A | |
| SCHEMBL2790763 | 0.74 | CYP2D6 (0.43) | ALDH1A1POLBHSD17B10TSHR |
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-0808308-B1 | METHOD FOR SEPARATING CARBINOLS | ESTEVE LABOR DR (ES) | 2001-03-07 | — | — | EP | claimed |
| US-5849931-A | Process for separating carbinols | LABORATORIOS DEL DR. ESTEVE S.A. (ES) | 1998-12-15 | — | — | US | claimed |