Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RAB9A | P51151 | 4/20 | 0.36 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | GAA | P10253 | 4/20 | 0.35 |
| ▸ | LMNA | P02545 | 3/20 | 0.35 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | XDH | P47989 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | HTT | P42858 | 1/20 | 0.34 |
| ▸ | PKM | P14618 | 1/20 | 0.33 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.33 |
| ▸ | LOXL2 | Q9Y4K0 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | HPGD | P15428 | 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 | |
|---|---|---|---|---|
| SCHEMBL11148944 | 0.76 | ALDH1A1 (0.39) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL9888403 | 0.76 | SMN1; SMN2 (0.48) | ALDH1A1LMNACYP2C9CYP2C19SMN1; SMN2 | |
| SCHEMBL30778197 | 0.75 | CYP19A1 (0.39) | RAB9AMAPTNPC1ALDH1A1SMN1; SMN2 | |
| SCHEMBL30778218 | 0.73 | MEN1 (0.34) | ALDH1A1CYP2C9CYP2C19SMN1; SMN2KMT2A | |
| SCHEMBL29281789 | 0.72 | XDH (0.33) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL29226423 | 0.71 | ALDH1A1 (0.44) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL29226418 | 0.71 | ALDH1A1 (0.44) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL29226425 | 0.71 | KDM4E (0.42) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL29226428 | 0.71 | KDM4E (0.42) | RAB9AMAPTNPC1ALDH1A1GAA | |
| SCHEMBL13499117 | 0.69 | ELANE (0.45) | RAB9AMAPTNPC1ALDH1A1GAA |
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 |
|---|---|---|---|---|---|---|---|
| CN-116444458-A | Method for realizing migration of remote aromatic heterocycle and direct alkyl heteroaryl of terminal olefin | 南京工业大学 | 2023-07-18 | — | — | CN | disclosed |