Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HTT | P42858 | 3/20 | 0.38 |
| ▸ | NPSR1 | Q6W5P4 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 3/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.38 |
| ▸ | PKM | P14618 | 2/20 | 0.38 |
| ▸ | ATM | Q13315 | 2/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | NLRP1 | Q9C000 | 1/20 | 0.38 |
| ▸ | NTSR1 | P30989 | 1/20 | 0.38 |
| ▸ | CES2 | O00748 | 2/20 | 0.37 |
| ▸ | CES1 | P23141 | 2/20 | 0.37 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | NPC1 | O15118 | 2/20 | 0.33 |
| ▸ | RAB9A | P51151 | 2/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL8292370 | 0.78 | MAOB (0.37) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL16068458 | 0.74 | ALDH1A1 (0.36) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL18726827 | 0.71 | SMN1; SMN2 (0.33) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL10071711 | 0.71 | ALDH1A1 (0.42) | ALDH1A1LMNASMN1; SMN2KMT2AMEN1 | |
| SCHEMBL7500354 | 0.70 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL19849034 | 0.70 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL21880243 | 0.70 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL7500360 | 0.70 | ALDH1A1 (0.43) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL18561940 | 0.67 | ALDH1A1 (0.36) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 | |
| SCHEMBL16068459 | 0.67 | ALDH1A1 (0.41) | ALDH1A1HTTNPSR1LMNASMN1; SMN2 |
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-2010058353-A1 | NOVEL BIS-AMIDES AS ANTIMALARIAL AGENTS | ACTELION PHARMACEUTICALS LTD (CH) | 2010-05-27 | — | — | WO | disclosed |