Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT1 | Q96EB6 | 5/20 | 0.67 |
| ▸ | NPC1 | O15118 | 5/20 | 0.64 |
| ▸ | RAB9A | P51151 | 5/20 | 0.64 |
| ▸ | MEN1 | O00255 | 3/20 | 0.64 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.63 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.63 |
| ▸ | PKM | P14618 | 1/20 | 0.63 |
| ▸ | TSHR | P16473 | 1/20 | 0.63 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.63 |
| ▸ | BLM | P54132 | 1/20 | 0.63 |
| ▸ | CDK4 | P11802 | 2/20 | 0.61 |
| ▸ | CCND1 | P24385 | 2/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 3/20 | 0.60 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
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 | |
|---|---|---|---|---|
| SCHEMBL28602534 | 0.80 | CA12 (0.56) | SIRT1MEN1KMT2A | |
| SCHEMBL6394942 | 0.79 | MEN1 (0.76) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28045701 | 0.79 | NPC1 (0.78) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL4331421 | 0.78 | MEN1 (1.00) | SIRT1NPC1RAB9AMEN1KMT2A | |
| Nb-Acetyltryptamine SCHEMBL468850 | 0.78 | MEN1 (1.00) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL15145374 | 0.77 | PTGS1 (0.75) | SIRT1NPC1RAB9AMEN1KMT2A | |
| Nb-Acetyltryptamine SCHEMBL29669230 | 0.77 | MEN1 (0.97) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL28477305 | 0.76 | PTGS1 (0.78) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL14198238 | 0.76 | CDK4 (0.77) | SIRT1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL15145387 | 0.76 | SIRT1 (0.76) | SIRT1NPC1RAB9AMEN1KMT2A |
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-112961143-A | Ligustrazine derivative and preparation method thereof | 河南省人民医院 | 2021-06-15 | — | — | CN | claimed |