Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | POLB | P06746 | 1/20 | 0.45 |
| ▸ | ALPG | P10696 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | GLA | P06280 | 1/20 | 0.39 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.38 |
| ▸ | MAPT | P10636 | 3/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 2/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.37 |
| ▸ | WNT3A | P56704 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | CA12 | O43570 | 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 | |
|---|---|---|---|---|
| SCHEMBL703438 | 0.85 | CA12 (0.53) | ALDH1A1SMN1; SMN2RAB9ANPC1NR1H4 | |
| SCHEMBL19924552 | 0.81 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL19924558 | 0.81 | ALDH1A1 (0.49) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL19935956 | 0.78 | ALDH1A1 (0.41) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL2123893 | 0.78 | ALDH1A1 (0.59) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL9378699 | 0.78 | ALDH1A1 (0.71) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL9144454 | 0.75 | RAB9A (0.69) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL7153475 | 0.74 | KDM4E (0.50) | ALDH1A1SMN1; SMN2RAB9ANPC1TP53 | |
| SCHEMBL3255990 | 0.74 | ALDH1A1 (0.52) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 | |
| SCHEMBL19924626 | 0.73 | ALDH1A1 (0.45) | ALDH1A1SMN1; SMN2POLBRAB9ANPC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-6355822-B1 | Process for selective reduction | DSM FINE CHEMICALS AUSTRIA NFG GMBH & COKG (AT) | 2002-03-12 | — | — | US | disclosed |
| EP-1069097-A2 | Method for selective reduction | DSM Fine Chemicals Austria GmbH (AT) | 2001-01-17 | — | — | EP | disclosed |