Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 5/20 | 0.39 |
| ▸ | GAA | P10253 | 3/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | HTT | P42858 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.34 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.34 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | CYP19A1 | P11511 | 4/20 | 0.32 |
| ▸ | LMNA | P02545 | 1/20 | 0.32 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL743497 | 0.76 | CA12 (0.43) | MAPTMAPK1ALDH1A1CYP3A4USP2 | |
| SCHEMBL161694 | 0.76 | ACHE (0.44) | MAPTGAAMAPK1ALDH1A1CYP3A4 | |
| SCHEMBL28179999 | 0.74 | ERN1 (0.35) | MAPTALDH1A1KDM4ETDP1POLB | |
| SCHEMBL27949662 | 0.74 | CYP3A4 (0.46) | MAPTMAPK1CYP3A4TDP1USP2 | |
| SCHEMBL27672401 | 0.74 | HTR2A (0.40) | TSHRMAPK1ALDH1A1KDM4ECYP3A4 | |
| SCHEMBL8121638 | 0.71 | NQO2 (0.40) | MAPTGAATSHRMAPK1ALDH1A1 | |
| SCHEMBL2039147 | 0.69 | AR (0.39) | ALDH1A1KDM4EUSP2MEN1KMT2A | |
| SCHEMBL8129611 | 0.68 | HTT (0.51) | MAPTGAAHTTALDH1A1KDM4E | |
| SCHEMBL28036008 | 0.66 | PDGFRB (0.42) | TSHRALDH1A1CYP3A4TDP1HSD17B10 | |
| SCHEMBL9979581 | 0.66 | CYP3A4 (0.38) | MAPTGAATSHRALDH1A1KDM4E |
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-110913855-A | Imidazole-containing ALK2 kinase inhibitors | 拜奥克里斯特制药公司 | 2020-03-24 | — | — | CN | disclosed |