Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 3/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | THRB | P10828 | 1/20 | 0.36 |
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
| ▸ | DPP4 | P27487 | 1/20 | 0.35 |
| ▸ | GRM5 | P41594 | 1/20 | 0.35 |
| ▸ | MCHR1 | Q99705 | 1/20 | 0.35 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL10825960 | 0.75 | ALDH1A1 (0.59) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL1169954 | 0.68 | ALDH1A1 (0.55) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL11797135 | 0.67 | ALDH1A1 (0.50) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL8993378 | 0.67 | ALDH1A1 (0.46) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL19318729 | 0.66 | GAA (0.52) | ALDH1A1SMN1; SMN2MAPTPKMMEN1 | |
| SCHEMBL11107247 | 0.66 | ALDH1A1 (0.57) | ALDH1A1CYP2C19CYP3A4CYP2C9SMN1; SMN2 | |
| SCHEMBL7924997 | 0.66 | LMNA (0.52) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL7937531 | 0.66 | ALDH1A1 (0.51) | ALDH1A1CYP2C19CYP3A4CYP2C9LMNA | |
| SCHEMBL28166528 | 0.65 | FFAR1 (0.49) | ALDH1A1FFAR1LMNACYP1A2SMN1; SMN2 | |
| SCHEMBL22548445 | 0.65 | GAA (0.50) | ALDH1A1CYP3A4SMN1; SMN2MAPTPKM |
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-6242478-B1 | ANTICARCINOGENIC AGENTS; REPLICATION INHIBITORS OF HUMAN LYMPHADENOPATHY ASSOCIATED VIRUS(HIV) | WAKE FOREST UNIVERSITY | 2001-06-05 | — | — | US | disclosed |