Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MEN1 | O00255 | 6/20 | 0.60 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.60 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.60 |
| ▸ | PKM | P14618 | 1/20 | 0.60 |
| ▸ | TSHR | P16473 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | BLM | P54132 | 1/20 | 0.60 |
| ▸ | MMP9 | P14780 | 1/20 | 0.58 |
| ▸ | AANAT | Q16613 | 1/20 | 0.58 |
| ▸ | NPC1 | O15118 | 1/20 | 0.58 |
| ▸ | RAB9A | P51151 | 1/20 | 0.58 |
| ▸ | FAAH | O00519 | 1/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.57 |
| ▸ | MAPT | P10636 | 2/20 | 0.57 |
| ▸ | GAA | P10253 | 1/20 | 0.57 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.56 |
| ▸ | HTR1A | P08908 | 1/20 | 0.56 |
| ▸ | HTR2A | P28223 | 1/20 | 0.56 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| Methyl Carbamate SCHEMBL6828080 | 0.86 | MEN1 (0.61) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL9559245 | 0.86 | MEN1 (0.68) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL6273998 | 0.85 | MEN1 (0.59) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL28242499 | 0.84 | HTR2A (0.64) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL627038 | 0.81 | MEN1 (0.74) | MEN1KMT2ALMNACYP1A2PKM | |
| Carbamic Acid SCHEMBL28875081 | 0.80 | MEN1 (0.64) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL17495629 | 0.80 | NMBR (0.59) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL6703001 | 0.79 | MMP9 (0.75) | MEN1KMT2ALMNACYP1A2PKM | |
| Tryptamine SCHEMBL9699478 | 0.79 | CYP1A2 (0.71) | MEN1KMT2ALMNACYP1A2PKM | |
| SCHEMBL9705533 | 0.78 | MEN1 (0.65) | MEN1KMT2ALMNACYP1A2PKM |
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-110041318-A | A kind of Human Dopamine D 5 Receptor agonist and its preparation and application | 中国科学院上海药物研究所 | 2019-07-23 | — | — | CN | disclosed |