Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 3/20 | 0.77 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.77 |
| ▸ | SIRT1 | Q96EB6 | 2/20 | 0.77 |
| ▸ | NPC1 | O15118 | 4/20 | 0.73 |
| ▸ | RAB9A | P51151 | 4/20 | 0.73 |
| ▸ | POLB | P06746 | 1/20 | 0.73 |
| ▸ | PTGS2 | P35354 | 9/20 | 0.69 |
| ▸ | PTGS1 | P23219 | 5/20 | 0.69 |
| ▸ | CDK4 | P11802 | 2/20 | 0.65 |
| ▸ | CCND1 | P24385 | 2/20 | 0.65 |
| ▸ | ATM | Q13315 | 1/20 | 0.64 |
| ▸ | LMNA | P02545 | 1/20 | 0.64 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.64 |
| ▸ | PKM | P14618 | 1/20 | 0.64 |
| ▸ | TSHR | P16473 | 1/20 | 0.64 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.64 |
| ▸ | BLM | P54132 | 1/20 | 0.64 |
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 | |
|---|---|---|---|---|
| SCHEMBL28407592 | 0.87 | PTGS1 (0.79) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL9276493 | 0.87 | MEN1 (1.00) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28412425 | 0.86 | PTGS2 (0.72) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28663013 | 0.86 | MEN1 (0.79) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28045660 | 0.85 | PTGS2 (0.80) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28045701 | 0.85 | NPC1 (0.78) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL13943094 | 0.85 | MEN1 (0.77) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL29990565 | 0.85 | MEN1 (0.77) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28195561 | 0.84 | MEN1 (0.75) | MEN1KMT2ASIRT1NPC1RAB9A | |
| SCHEMBL28408669 | 0.83 | PTGS1 (0.74) | MEN1KMT2ARAB9APOLBPTGS2 |
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-111116449-A | Novel tryptamine derivative and preparation method and application thereof | 兰州大学 | 2020-05-08 | — | — | CN | disclosed |