Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.55 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | HTT | P42858 | 1/20 | 0.52 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.52 |
| ▸ | APP | P05067 | 2/20 | 0.51 |
| ▸ | RAB9A | P51151 | 2/20 | 0.49 |
| ▸ | MEN1 | O00255 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | TERT | O14746 | 1/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | NSD2 | O96028 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL25463626 | 0.92 | NFKB1 (0.51) | NPC1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL25463662 | 0.86 | NPC1 (0.45) | NPC1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL25463685 | 0.84 | NR1I2 (0.45) | NPC1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11785244 | 0.81 | NPC1 (0.77) | NPC1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL11849372 | 0.80 | MAPK1 (0.46) | NPC1NPSR1RAB9AMEN1KMT2A | |
| SCHEMBL11644252 | 0.80 | MAPK1 (0.46) | NPC1NPSR1RAB9AMEN1KMT2A | |
| SCHEMBL6536659 | 0.77 | NPC1 (0.72) | NPC1CYP1A2CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL6123719 | 0.76 | MAPT (0.70) | NPC1HTTRAB9AMEN1KMT2A | |
| SCHEMBL13313311 | 0.76 | MAPT (0.70) | NPC1HTTRAB9AMEN1KMT2A | |
| SCHEMBL14866759 | 0.75 | ALDH1A1 (0.71) | NPC1RAB9AMEN1KMT2AMAPT |
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-20230151218-A1 | Reactive Disperse Yellow Dye for Supercritical CO2 Dyeing and Methods of Production and Use Thereof | DALIAN POLYTECHNIC UNIVERSITY (CN) | 2023-05-18 | — | — | US | disclosed |