Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 7/20 | 0.39 |
| ▸ | CYP1A2 | P05177 | 6/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 6/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.39 |
| ▸ | USP2 | O75604 | 2/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 6/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 4/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.38 |
| ▸ | CLK4 | Q9HAZ1 | 3/20 | 0.38 |
| ▸ | LMNA | P02545 | 2/20 | 0.38 |
| ▸ | GLA | P06280 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25411495 | 0.88 | P2RX7 (0.38) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30451216 | 0.85 | ALDH1A1 (0.41) | TSHRMEN1KMT2AALDH1A1HSD17B10 | |
| SCHEMBL25409041 | 0.85 | P2RX7 (0.36) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL25410665 | 0.85 | P2RX7 (0.36) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL25412445 | 0.85 | P2RX7 (0.36) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30305424 | 0.84 | TGFBR1 (0.37) | TSHRCYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL23985112 | 0.84 | TGFBR1 (0.37) | TSHRCYP1A2CYP3A4CYP2C19ALDH1A1 | |
| SCHEMBL25413619 | 0.84 | P2RX7 (0.35) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 | |
| SCHEMBL30451063 | 0.83 | ALDH1A1 (0.40) | TSHRMEN1KMT2AALDH1A1HSD17B10 | |
| SCHEMBL30305525 | 0.83 | CYP1A2 (0.40) | TSHRCYP1A2CYP3A4CYP2D6CYP2C19 |
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-116261562-A | PI 3K-alpha inhibitors and methods of use thereof | 传达治疗有限公司 | 2023-06-13 | — | — | CN | disclosed |