Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.38 |
| ▸ | NR3C1 | P04150 | 3/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 3/20 | 0.34 |
| ▸ | GLA | P06280 | 2/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.34 |
| ▸ | HASPIN | Q8TF76 | 1/20 | 0.34 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL8127712 | 0.83 | HTR2A (0.40) | HTR2AMAPTNR3C1KMT2AHASPIN | |
| SCHEMBL22803797 | 0.82 | HTR2A (0.37) | HTR2ANR3C1ALDH1A1HSD17B10KDM4E | |
| SCHEMBL827227 | 0.82 | HTR2A (0.41) | HTR2AMAPTALDH1A1HPGDCYP3A4 | |
| SCHEMBL27973166 | 0.81 | MPL (0.44) | MAPTALDH1A1HSD17B10KDM4EHPGD | |
| SCHEMBL22803765 | 0.80 | HTR2A (0.41) | HTR2AMAPTALDH1A1CYP2D6KMT2A | |
| SCHEMBL22803795 | 0.80 | HTR2A (0.61) | HTR2AMAPTCYP3A4CYP2D6KMT2A | |
| SCHEMBL22783757 | 0.79 | ALDH1A1 (0.50) | ALDH1A1NR4A2 | |
| SCHEMBL19329521 | 0.79 | HTR6 (0.35) | HTR2AALDH1A1DAODDOGRIN2D | |
| SCHEMBL8326707 | 0.79 | HTR2A (0.37) | HTR2ANR3C1CYP2D6CYP2C9CYP2C19 | |
| SCHEMBL22803796 | 0.78 | CHRNB2 (0.50) | HTR2AMAPTALDH1A1KDM4ELMNA |
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-2022268025-A1 | ATR INHIBITOR AND USE THEREOF | 成都苑东生物制药股份有限公司 | 2022-12-29 | — | — | WO | disclosed |