Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.52 |
| ▸ | F2 | P00734 | 1/20 | 0.50 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.47 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.47 |
| ▸ | ACP3 | P15309 | 1/20 | 0.47 |
| ▸ | F10 | P00742 | 2/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | HPGD | P15428 | 1/20 | 0.44 |
| ▸ | GABBR2 | O75899 | 1/20 | 0.43 |
| ▸ | GABBR1 | Q9UBS5 | 1/20 | 0.43 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.43 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.43 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.43 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL28380583 | 0.86 | F2 (0.52) | F2ACP3F10TSHRGABBR2 | |
| SCHEMBL13559962 | 0.83 | GABBR2 (0.53) | ALDH1A1MTNR1AMTNR1BMEN1KMT2A | |
| SCHEMBL4560570 | 0.83 | F2 (0.53) | ALDH1A1F2ACP3F10SMN1; SMN2 | |
| SCHEMBL11542680 | 0.82 | MTNR1A (0.63) | ALDH1A1MTNR1AMTNR1BACP3GABBR2 | |
| SCHEMBL11635782 | 0.82 | ALDH1A1 (0.56) | ALDH1A1MTNR1AMTNR1B | |
| SCHEMBL8087232 | 0.81 | ATM (0.56) | ALDH1A1F2ACP3F10TSHR | |
| SCHEMBL9678409 | 0.79 | POLB (0.49) | ALDH1A1F2MTNR1AMTNR1BGABBR2 | |
| SCHEMBL1538332 | 0.79 | CYP19A1 (0.54) | ALDH1A1ACP3SMN1; SMN2HPGDCYP19A1 | |
| SCHEMBL6444313 | 0.79 | MMP12 (0.60) | ALDH1A1TSHRMEN1HTTKMT2A | |
| SCHEMBL6444318 | 0.79 | MMP12 (0.60) | ALDH1A1TSHRMEN1HTTKMT2A |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2350018-A1 | HISTIDINOL DEHYDROGENASE INHIBITORS, AND USE THEREOF AS MEDICAMENTS | Centre National de la Recherche Scientifique (FR) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010055254-A1 | HISTIDINOL DEHYDROGENASE INHIBITORS, AND USE THEREOF AS MEDICAMENTS | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2010-05-20 | — | — | WO | disclosed |
| EP-0937703-B1 | METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS | SUMITOMO CHEMICAL CO (JP) | 2003-05-21 | — | — | EP | disclosed |
| EP-0937703-A1 | METHOD FOR PURIFYING PYRUVIC ACID COMPOUNDS | SUMITOMO CHEMICAL COMPANY LIMITED (JP) | 1999-08-25 | — | — | EP | disclosed |