Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GAA | P10253 | 2/20 | 0.64 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.62 |
| ▸ | MAPT | P10636 | 2/20 | 0.62 |
| ▸ | MEN1 | O00255 | 2/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | GFER | P55789 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.56 |
| ▸ | POLB | P06746 | 1/20 | 0.55 |
| ▸ | F10 | P00742 | 4/20 | 0.54 |
| ▸ | NPC1 | O15118 | 2/20 | 0.53 |
| ▸ | TP53 | P04637 | 1/20 | 0.53 |
| ▸ | GLA | P06280 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | RAB9A | P51151 | 1/20 | 0.53 |
| ▸ | ACACB | O00763 | 1/20 | 0.53 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL15203335 | 0.84 | SMN1; SMN2 (0.59) | ALDH1A1MAPTSMN1; SMN2F10NPC1 | |
| SCHEMBL7150779 | 0.84 | HTT (0.63) | ALDH1A1MAPTSMN1; SMN2POLBF10 | |
| SCHEMBL1677992 | 0.84 | MEN1 (0.60) | GAAALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL14408269 | 0.81 | FPR1 (0.56) | ALDH1A1MAPTMEN1KMT2AGFER | |
| SCHEMBL6566772 | 0.81 | SMN1; SMN2 (0.53) | ALDH1A1MAPTGFERSMN1; SMN2POLB | |
| SCHEMBL14525364 | 0.81 | SMN1; SMN2 (0.53) | ALDH1A1MAPTGFERSMN1; SMN2F10 | |
| SCHEMBL5388748 | 0.81 | ALDH1A1 (0.51) | GAAALDH1A1MAPTSMN1; SMN2F10 | |
| SCHEMBL4388140 | 0.80 | JAK2 (0.73) | — | |
| SCHEMBL29605678 | 0.80 | SMN1; SMN2 (0.61) | GAAALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL17507085 | 0.80 | SMN1; SMN2 (0.55) | GAAALDH1A1MAPTMEN1KMT2A |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-4668614-B2 | — | — | 2011-04-13 | — | — | JP | claimed |
| JP-2006500369-A | — | — | 2006-01-05 | — | — | JP | claimed |
| EP-1558247-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GmbH (DE) | 2005-08-03 | — | — | EP | claimed |
| WO-2004017963-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2004-03-04 | — | — | WO | claimed |
| CN-111170992-B | Preparation method of 5, 6-dihydropyridine-2 (1H) -ketone derivative | 新发药业有限公司 | 2021-05-14 | — | — | CN | disclosed |
| CN-111170992-A | Preparation method of 5, 6-dihydropyridine-2 (1H) -ketone derivative | 新发药业有限公司 | 2020-05-19 | — | — | CN | disclosed |
| EP-1558247-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GmbH (DE) | 2005-08-03 | — | — | EP | disclosed |
| WO-2004017963-A1 | BENZIMIDAZOLE DERIVATIVES | MERCK PATENT GMBH (DE) | 2004-03-04 | — | — | WO | disclosed |
| EP-1351938-A1 | PHENYL DERIVATIVES | MERCK PATENT GmbH (DE) | 2003-10-15 | — | — | EP | disclosed |
| WO-2002057236-A1 | PHENYL DERIVATIVES | MERCK PATENT GMBH (DE) | 2002-07-25 | — | — | WO | disclosed |