Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | PKM | P14618 | 1/20 | 0.56 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | PPARG | P37231 | 1/20 | 0.46 |
| ▸ | PPARA | Q07869 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | MEN1 | O00255 | 2/20 | 0.45 |
| ▸ | RHOA | P61586 | 1/20 | 0.44 |
| ▸ | P2RX3 | P56373 | 2/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | TLR4 | O00206 | 1/20 | 0.43 |
| ▸ | TLR2 | O60603 | 1/20 | 0.43 |
| ▸ | MAOA | P21397 | 1/20 | 0.43 |
| ▸ | MAOB | P27338 | 1/20 | 0.43 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL11546773 | 0.87 | CYP1A2 (0.57) | ALDH1A1KDM4ECYP1A2PPARGPPARA | |
| SCHEMBL11545984 | 0.87 | KDM4E (0.52) | ALDH1A1KDM4ESMN1; SMN2PKML3MBTL1 | |
| SCHEMBL11548488 | 0.87 | SMN1; SMN2 (0.52) | ALDH1A1KDM4ESMN1; SMN2PKML3MBTL1 | |
| SCHEMBL11546998 | 0.85 | ALDH1A1 (0.58) | ALDH1A1KDM4ESMN1; SMN2PKMKMT2A | |
| SCHEMBL11548051 | 0.84 | MAPT (0.53) | ALDH1A1KDM4ESMN1; SMN2PKMCYP1A2 | |
| SCHEMBL11621308 | 0.82 | ALDH1A1 (0.58) | ALDH1A1KDM4ESMN1; SMN2PKMKMT2A | |
| SCHEMBL11683611 | 0.81 | KDM4E (0.70) | ALDH1A1KDM4ESMN1; SMN2PKMRHOA | |
| SCHEMBL11683613 | 0.81 | KDM4E (0.70) | ALDH1A1KDM4ESMN1; SMN2PKMRHOA | |
| SCHEMBL8783371 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2PKML3MBTL1 | |
| SCHEMBL8942607 | 0.80 | ALDH1A1 (0.57) | ALDH1A1KDM4ESMN1; SMN2PKML3MBTL1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4144351-A | ANTICHOLESTEROL | KLINGE PHARMA GMBH & CO. (DE) | 1979-03-13 | — | — | US | disclosed |
| US-4109013-A | SUBSTITUTED PROPANOL-(2) DERIVATIVES OF HYDROXAMIC ACIDS AND THE USE THEREOF AS HYPOLIPEMIC DRUGS | KLINGE PHARMA GMBH & CO. (DE) | 1978-08-22 | — | — | US | disclosed |
| US-4073935-A | Substituted propanol-(2)-derivatives and their nicotinic acid esters, and process for their preparation, and the use thereof as hypolipemic drugs | KLINGE PHARMA GMBH & CO. (DT) | 1978-02-14 | — | — | US | disclosed |