Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | HTT | P42858 | 3/20 | 0.46 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | ATM | Q13315 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.46 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | CES2 | O00748 | 3/20 | 0.41 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | MAPT | P10636 | 4/20 | 0.41 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | PTAFR | P25105 | 2/20 | 0.40 |
| ▸ | TGM2 | P21980 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 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 | |
|---|---|---|---|---|
| SCHEMBL3431718 | 0.84 | ALDH5A1 (0.50) | ALDH1A1HTTLMNAPKMHPGD | |
| SCHEMBL16062004 | 0.82 | CA1 (0.47) | ALDH1A1PKMHPGDCES2CES1 | |
| SCHEMBL4102547 | 0.80 | ALDH1A1 (0.58) | ALDH1A1HTTNPSR1LMNAPKM | |
| SCHEMBL4102553 | 0.80 | ALDH1A1 (0.58) | ALDH1A1HTTNPSR1LMNAPKM | |
| SCHEMBL3943070 | 0.76 | CES2 (0.53) | ALDH1A1HTTNPSR1LMNAPKM | |
| SCHEMBL3943076 | 0.76 | CES2 (0.53) | ALDH1A1HTTNPSR1LMNAPKM | |
| SCHEMBL3941917 | 0.76 | CES2 (0.53) | ALDH1A1HTTNPSR1LMNAPKM | |
| SCHEMBL3691262 | 0.73 | SLC22A6 (0.53) | HTTMEN1KMT2ARAB9AHDAC6 | |
| SCHEMBL1134679 | 0.73 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1LMNAPKM | |
| Bicarbonate SCHEMBL9519795 | 0.73 | ALDH1A1 (0.48) | ALDH1A1HTTNPSR1LMNAPKM |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010068935-A2 | SMALL MOLECULE IMMUNOMODULATORS FOR ALZHEIMER'S DISEASE | HUMAN BIOMOLECULAR RESEARCH INSTITUTE (US) | 2010-06-17 | — | — | WO | disclosed |