Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | GAA | P10253 | 6/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.42 |
| ▸ | MEN1 | O00255 | 3/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.41 |
| ▸ | NPC1 | O15118 | 4/20 | 0.41 |
| ▸ | RAB9A | P51151 | 4/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 3/20 | 0.36 |
| ▸ | TP53 | P04637 | 2/20 | 0.36 |
| ▸ | HPGD | P15428 | 2/20 | 0.36 |
| ▸ | OPRM1 | P35372 | 1/20 | 0.36 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.36 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | NOX1 | Q9Y5S8 | 2/20 | 0.35 |
| ▸ | LMNA | P02545 | 2/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL29976397 | 1.00 | ATM (0.46) | ATMGAAKDM4EMEN1KMT2A | |
| SCHEMBL28555387 | 0.84 | OPRD1 (0.40) | ATMGAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL29976016 | 0.84 | OPRD1 (0.40) | ATMGAAMEN1KMT2ASMN1; SMN2 | |
| SCHEMBL2125224 | 0.84 | GAA (0.43) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL29976025 | 0.84 | GAA (0.43) | GAAKDM4EMEN1KMT2AALDH1A1 | |
| SCHEMBL29976493 | 0.79 | KMT2A (0.39) | GAAKMT2AMAPTOPRM1POLB | |
| SCHEMBL28551749 | 0.79 | KMT2A (0.39) | GAAKMT2AMAPTOPRM1POLB | |
| SCHEMBL19216987 | 0.76 | KMT2A (0.42) | ATMGAAKDM4EMEN1KMT2A | |
| SCHEMBL28544023 | 0.73 | GAA (0.36) | GAAMAPT | |
| SCHEMBL29976118 | 0.73 | GAA (0.36) | GAAMAPT |
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-112409253-B | Method for synthesizing chiral alpha-tertiary amine by catalytic kinetic resolution | 上海科技大学 | 2022-11-29 | — | — | CN | disclosed |
| CN-112409253-A | Method for synthesizing chiral alpha-tertiary amine by catalytic kinetic resolution | 上海科技大学 | 2021-02-26 | — | — | CN | disclosed |