Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.46 |
| ▸ | GAA | P10253 | 5/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | GLA | P06280 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 4/20 | 0.46 |
| ▸ | CASP1 | P29466 | 3/20 | 0.46 |
| ▸ | CASP7 | P55210 | 3/20 | 0.46 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 2/20 | 0.45 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTR2B | P41595 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL28854641 | 0.87 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL21180531 | 0.82 | ALDH1A1 (0.46) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL29046363 | 0.80 | ALDH1A1 (0.73) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL26970375 | 0.77 | ALDH1A1 (0.44) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL30512143 | 0.76 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL29234076 | 0.73 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL28854617 | 0.73 | ALDH1A1 (0.68) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL30502408 | 0.73 | GAA (0.66) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL30502405 | 0.73 | ALDH1A1 (0.66) | ALDH1A1GAAKDM4EGLAHPGD | |
| SCHEMBL28854619 | 0.72 | ALDH1A1 (0.67) | ALDH1A1GAAKDM4EGLAHPGD |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-10167966-A | — | — | None | — | — | JP | disclosed |
| JP-60038336-A | — | — | None | — | — | JP | disclosed |
| CN-111362941-A | Visible light preparation method of aza-tetraacetalkane compounds | 北京工业大学 | 2020-07-03 | — | — | CN | disclosed |
| US-RE36607-E | Pyrrolidine compounds and process of preparing | BAYER AKTIENGESELLSCHAFT (DE) | 2000-03-07 | — | — | US | disclosed |
| US-5910593-A | Highly selective process for the preparation of enantiomerically pure phenylsubstituted 1,4-dihydropyridine-3,5-dicarboxylic acid derivatives | BAYER AKTIENGESELLSCHAFT (DE) | 1999-06-08 | — | — | US | disclosed |
| US-5849924-A | Highly selective process for the preparation of enantiomerically pure phenyl-substituted 1,4-dihydropyridine-3,5-dicarboxylic acid derivatives | BAYER AKTIENGESELLSCAHFT (DE) | 1998-12-15 | — | — | US | disclosed |
| JP-H10167966-A | ORAL SUSTAINED RELEASE PREPARATION | NIPPON CHEMIPHAR CO LTD | 1998-06-23 | — | — | JP | disclosed |
| US-5700948-A | CALCIUM ANTAGONISTS | BAYER AKTIENGESELLSCHAFT (DE) | 1997-12-23 | — | — | US | disclosed |
| US-5272161-A | Indolesulphonamide-substituted dihydropyridines | BAYER AKTIENGESELLSCHAFT (DE) | 1993-12-21 | — | — | US | disclosed |
| EP-0533014-A1 | Indolesulfonamide substituted dihydropyridines, process for their preparation and drugs containing them | BAYER AG (DE) | 1993-03-24 | — | — | EP | disclosed |
| JP-S6038336-A | BENZALDEHYDE DERIVATIVE AND ITS PREPARATION | TEIJIN LTD | 1985-02-27 | — | — | JP | disclosed |