Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 9/20 | 0.50 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.50 |
| ▸ | DDAH1 | O94760 | 1/20 | 0.50 |
| ▸ | HRH1 | P35367 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 6/20 | 0.39 |
| ▸ | PKM | P14618 | 5/20 | 0.39 |
| ▸ | POLB | P06746 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HPGD | P15428 | 3/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | CTSL | P07711 | 1/20 | 0.39 |
| ▸ | CTSB | P07858 | 1/20 | 0.39 |
| ▸ | CTSS | P25774 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5869874 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KDM4ECYP2C19CYP1A2SMN1; SMN2 | |
| SCHEMBL5869518 | 1.00 | ALDH1A1 (0.50) | ALDH1A1KDM4ECYP2C19CYP1A2SMN1; SMN2 | |
| SCHEMBL5869827 | 0.91 | HRH1 (0.49) | ALDH1A1CYP2C19HRH1MAPTPKM | |
| SCHEMBL5869822 | 0.91 | HRH1 (0.49) | ALDH1A1CYP2C19HRH1MAPTPKM | |
| SCHEMBL5869815 | 0.91 | HRH1 (0.49) | ALDH1A1CYP2C19HRH1MAPTPKM | |
| SCHEMBL6924748 | 0.91 | HRH1 (0.49) | ALDH1A1CYP2C19HRH1MAPTPKM | |
| SCHEMBL5869729 | 0.89 | ALDH1A1 (0.49) | ALDH1A1KDM4ESMN1; SMN2HRH1MAPT | |
| SCHEMBL5869333 | 0.89 | ALDH1A1 (0.49) | ALDH1A1KDM4ESMN1; SMN2HRH1MAPT | |
| SCHEMBL5869737 | 0.89 | ALDH1A1 (0.49) | ALDH1A1KDM4ESMN1; SMN2HRH1MAPT | |
| SCHEMBL6932573 | 0.89 | ALDH1A1 (0.49) | ALDH1A1KDM4ESMN1; SMN2HRH1MAPT |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7045532-B2 | ACE-2 modulating compounds and methods of use thereof | MILLENNIUM PHARMACEUTICALS, INC. (US) | 2006-05-16 | — | — | US | disclosed |