Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.62 |
| ▸ | NPC1 | O15118 | 4/20 | 0.62 |
| ▸ | RAB9A | P51151 | 4/20 | 0.62 |
| ▸ | SIRT1 | Q96EB6 | 6/20 | 0.61 |
| ▸ | PTGS1 | P23219 | 2/20 | 0.61 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.58 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.58 |
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | TSHR | P16473 | 1/20 | 0.58 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.58 |
| ▸ | BLM | P54132 | 1/20 | 0.58 |
| ▸ | CDK4 | P11802 | 2/20 | 0.58 |
| ▸ | CCND1 | P24385 | 2/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.58 |
| ▸ | MMP9 | P14780 | 1/20 | 0.56 |
| ▸ | AANAT | Q16613 | 1/20 | 0.56 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL28648966 | 0.83 | SIRT1 (0.63) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL28653378 | 0.83 | PTGS2 (0.63) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL28641186 | 0.83 | PTGS1 (0.67) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL28643657 | 0.81 | PTGS1 (0.79) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL15145332 | 0.81 | PTGS1 (0.74) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL15145387 | 0.80 | SIRT1 (0.76) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL7866515 | 0.79 | MEN1 (0.73) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL4331421 | 0.77 | MEN1 (1.00) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL28643652 | 0.77 | PTGS2 (0.76) | MEN1KMT2ANPC1RAB9ASIRT1 | |
| SCHEMBL28926969 | 0.77 | NPC1 (0.76) | MEN1KMT2ANPC1RAB9ASIRT1 |
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-113563250-A | Benzoic acid tryptamine derivative and preparation and application thereof | 南华大学 | 2021-10-29 | — | — | CN | disclosed |