Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX1 | P07099 | 1/20 | 0.56 |
| ▸ | HPGD | P15428 | 1/20 | 0.51 |
| ▸ | USP30 | Q70CQ3 | 3/20 | 0.48 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | CA1 | P00915 | 1/20 | 0.47 |
| ▸ | CA2 | P00918 | 1/20 | 0.47 |
| ▸ | THRB | P10828 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | PREP | P48147 | 2/20 | 0.44 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.42 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.42 |
| ▸ | ABL1 | P00519 | 1/20 | 0.42 |
| ▸ | RIN1 | Q13671 | 1/20 | 0.42 |
| ▸ | PARP1 | P09874 | 2/20 | 0.41 |
| ▸ | FPR3 | P25089 | 1/20 | 0.41 |
| ▸ | FPR2 | P25090 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL28779705 | 1.00 | EPHX1 (0.56) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779706 | 0.98 | EPHX1 (0.57) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779709 | 0.98 | EPHX1 (0.57) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779710 | 0.97 | EPHX1 (0.59) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779713 | 0.97 | EPHX1 (0.59) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL4268788 | 0.95 | EPHX1 (0.54) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL5666472 | 0.95 | EPHX1 (0.57) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779698 | 0.95 | EPHX1 (0.57) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL28779715 | 0.95 | EPHX1 (0.54) | EPHX1HPGDUSP30MEN1ALDH1A1 | |
| SCHEMBL17699916 | 0.95 | EPHX1 (0.54) | EPHX1HPGDUSP30MEN1ALDH1A1 |
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-114717211-B | Imine reductase mutant M5 and application thereof in synthesis of nitrogen heterocycle chiral amine | 江苏集萃分子工程研究院有限公司 | 2023-06-02 | — | — | CN | disclosed |
| CN-114717211-A | Imine reductase mutant M5 and application thereof in synthesis of azacyclo chiral amine | 江苏集萃分子工程研究院有限公司 | 2022-07-08 | — | — | CN | disclosed |