Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 6/20 | 0.42 |
| ▸ | MEN1 | O00255 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 2/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | EGFR | P00533 | 1/20 | 0.42 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.42 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.40 |
| ▸ | CIT | O14578 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | MAOA | P21397 | 1/20 | 0.39 |
| ▸ | SRD5A2 | P31213 | 2/20 | 0.39 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.39 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.39 |
| ▸ | NR4A3 | Q92570 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | ACACB | O00763 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL28711269 | 1.00 | KMT2A (0.42) | KMT2AMEN1HPGDALDH1A1MAPT | |
| SCHEMBL616398 | 0.90 | HPGD (0.47) | KMT2AHPGDALDH1A1CYP3A4HIF1A | |
| SCHEMBL24986138 | 0.87 | ROCK2 (0.47) | KMT2AMEN1HPGDALDH1A1MAPT | |
| SCHEMBL28712598 | 0.87 | ROCK2 (0.47) | KMT2AMEN1HPGDALDH1A1MAPT | |
| SCHEMBL27337700 | 0.78 | HDAC1 (0.53) | KMT2AMEN1HPGDALDH1A1EGFR | |
| SCHEMBL1818244 | 0.75 | TSHR (0.43) | KMT2AMEN1HPGDALDH1A1EGFR | |
| SCHEMBL5232476 | 0.74 | SRD5A2 (0.51) | KMT2AMEN1HPGDALDH1A1MAPT | |
| SCHEMBL11404152 | 0.73 | EGFR (0.45) | KMT2AALDH1A1EGFRERBB2NPC1 | |
| SCHEMBL6672366 | 0.73 | MLYCD (0.54) | KMT2AMEN1HPGDALDH1A1MAPT | |
| SCHEMBL616619 | 0.72 | HPGD (0.49) | KMT2AHPGDALDH1A1MAPTNPC1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116120240-A | FXIa inhibitor compound, preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-05-16 | — | — | CN | disclosed |
| CN-114206854-B | FXIa inhibitor and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-02-24 | — | — | CN | disclosed |
| CN-114206854-A | FXIa inhibitor and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2022-03-18 | — | — | CN | disclosed |