Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.71 |
| ▸ | PKM | P14618 | 1/20 | 0.71 |
| ▸ | ALOX12 | P18054 | 2/20 | 0.63 |
| ▸ | NPC1 | O15118 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.63 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.63 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.55 |
| ▸ | MAOB | P27338 | 2/20 | 0.55 |
| ▸ | MAOA | P21397 | 1/20 | 0.55 |
| ▸ | ATM | Q13315 | 1/20 | 0.55 |
| ▸ | MEN1 | O00255 | 1/20 | 0.55 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.55 |
| ▸ | HTT | P42858 | 1/20 | 0.53 |
| ▸ | GAA | P10253 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL18894145 | 0.86 | ALDH1A1 (0.73) | ALDH1A1PKMALOX12NPC1CYP1A2 | |
| SCHEMBL4588187 | 0.84 | ALDH1A1 (0.62) | ALDH1A1PKMNPC1CYP2C9CYP2C19 | |
| SCHEMBL3822991 | 0.84 | ALDH1A1 (1.00) | ALDH1A1PKMALOX12LMNAMAOB | |
| SCHEMBL11422909 | 0.81 | ALDH1A1 (0.65) | ALDH1A1PKMALOX12NPC1CYP1A2 | |
| SCHEMBL6211890 | 0.81 | ALDH1A1 (0.80) | ALDH1A1PKMALOX12LMNAKDM4E | |
| SCHEMBL318068 | 0.80 | ALDH1A1 (0.73) | ALDH1A1PKMALOX12LMNAMAOB | |
| SCHEMBL28230906 | 0.80 | ALDH1A1 (0.63) | ALDH1A1PKMALOX12NPC1CYP1A2 | |
| SCHEMBL21387041 | 0.80 | ALDH1A1 (0.73) | ALDH1A1PKMALOX12NPC1CYP1A2 | |
| SCHEMBL29484159 | 0.80 | PLA2G1B (0.68) | ALDH1A1ALOX12LMNAMAOBMEN1 | |
| SCHEMBL29484161 | 0.80 | CYP2C9 (0.69) | ALDH1A1ALOX12CYP2C9CYP2C19NPSR1 |
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-2022055940-A1 | VISTA INHIBITORS | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2022-03-17 | — | — | WO | disclosed |