Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GBA1 | P04062 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | USP2 | O75604 | 5/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 4/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.41 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 2/20 | 0.41 |
| ▸ | PAK4 | O96013 | 4/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | EIF2AK2 | P19525 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL21758307 | 0.93 | GBA1 (0.44) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL31297726 | 0.91 | GBA1 (0.48) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL21758677 | 0.91 | GBA1 (0.48) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL21758303 | 0.89 | GBA1 (0.47) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL31297734 | 0.89 | GBA1 (0.47) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL31297706 | 0.88 | GBA1 (0.46) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL21753176 | 0.88 | GBA1 (0.46) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL31297719 | 0.87 | GBA1 (0.45) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL21758434 | 0.87 | GBA1 (0.45) | GBA1KMT2AMEN1USP2CYP1A2 | |
| SCHEMBL21758311 | 0.87 | GBA1 (0.47) | GBA1KMT2AMEN1USP2CYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2020039093-A1 | TETRAHYDROPYRIDOPYRIMIDINE DERIVATIVES AS AHR MODULATORS | JAGUAHR THERAPEUTICS PTE LTD (SG) | 2020-02-27 | — | — | WO | disclosed |