Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | METAP2 | P50579 | 1/20 | 0.58 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | MAPT | P10636 | 2/20 | 0.56 |
| ▸ | TSHR | P16473 | 2/20 | 0.56 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.56 |
| ▸ | BCAT2 | O15382 | 1/20 | 0.50 |
| ▸ | NPC1 | O15118 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.45 |
| ▸ | CTNNB1 | P35222 | 1/20 | 0.45 |
| ▸ | SIRT1 | Q96EB6 | 1/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.44 |
| ▸ | ELANE | P08246 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | PARP1 | P09874 | 1/20 | 0.44 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL700922 | 1.00 | METAP2 (0.58) | METAP2KDM4EALDH1A1MAPTTSHR | |
| Hydrochloric Acid SCHEMBL4100040 | 0.98 | METAP2 (0.56) | METAP2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL4880477 | 0.98 | METAP2 (0.56) | METAP2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL29046760 | 0.98 | METAP2 (0.56) | METAP2KDM4EALDH1A1MAPTTSHR | |
| Hydrochloric Acid SCHEMBL4383251 | 0.98 | METAP2 (0.56) | METAP2KDM4EALDH1A1MAPTTSHR | |
| Hydrochloric Acid SCHEMBL4100039 | 0.95 | METAP2 (0.54) | METAP2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL29941064 | 0.82 | BCAT2 (0.59) | METAP2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL1898665 | 0.82 | BCAT2 (0.59) | METAP2KDM4EALDH1A1MAPTTSHR | |
| Acrylic Acid SCHEMBL28948916 | 0.82 | HPGD (0.42) | METAP2KDM4EALDH1A1MAPTTSHR | |
| SCHEMBL3170417 | 0.81 | METAP2 (0.48) | METAP2KDM4EALDH1A1MAPTTSHR |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112574054-B | Efficient nitriding reagent and application thereof | 北京大学 | 2022-10-14 | — | — | CN | disclosed |
| CN-86108331-A | The halogenated radioactive small molecule of labelled protein | — | 1987-11-04 | — | — | CN | disclosed |