Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 5/20 | 0.62 |
| ▸ | HPGD | P15428 | 4/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | MEN1 | O00255 | 1/20 | 0.61 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.60 |
| ▸ | ATM | Q13315 | 1/20 | 0.60 |
| ▸ | LMNA | P02545 | 1/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.54 |
| ▸ | WNT3A | P56704 | 1/20 | 0.54 |
| ▸ | POLB | P06746 | 1/20 | 0.53 |
| ▸ | PKM | P14618 | 1/20 | 0.53 |
| ▸ | RECQL | P46063 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL31151793 | 0.89 | HPGD (0.65) | HPGDALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL8573730 | 0.89 | HPGD (0.65) | HPGDALDH1A1MEN1KMT2ANPC1 | |
| SCHEMBL17558068 | 0.83 | TSHR (0.57) | TSHRHPGDALDH1A1GAAMEN1 | |
| SCHEMBL17888022 | 0.83 | TSHR (0.57) | TSHRHPGDALDH1A1GAAMEN1 | |
| SCHEMBL19864447 | 0.81 | PRKCI (0.57) | TSHRHPGDALDH1A1GAAMEN1 | |
| SCHEMBL17888020 | 0.81 | TSHR (0.65) | TSHRHPGDALDH1A1GAAMEN1 | |
| SCHEMBL102971 | 0.79 | KDM4E (0.89) | TSHRHPGDMEN1KMT2AKDM4E | |
| SCHEMBL3782345 | 0.79 | CTNNB1 (0.57) | TSHRHPGDALDH1A1GAAMEN1 | |
| SCHEMBL4824992 | 0.79 | NPSR1 (0.74) | TSHRHPGDKDM4EATMNPC1 | |
| SCHEMBL17888021 | 0.79 | MEN1 (0.57) | TSHRHPGDALDH1A1GAAMEN1 |
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-110092774-B | Aromatic propionic acid derivative, preparation method and application thereof | 中国科学院上海药物研究所 | 2022-04-08 | — | — | CN | disclosed |