Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KMT2A | Q03164 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 2/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 2/20 | 0.50 |
| ▸ | GAA | P10253 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | MAOA | P21397 | 3/20 | 0.41 |
| ▸ | MAOB | P27338 | 3/20 | 0.41 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.41 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.40 |
| ▸ | TRPM8 | Q7Z2W7 | 1/20 | 0.40 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.40 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.40 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.40 |
| ▸ | IDO1 | P14902 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.39 |
| ▸ | ADRB2 | P07550 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL28930287 | 0.92 | CYP1B1 (0.44) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL291980 | 0.85 | ALDH1A1 (0.48) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL25321818 | 0.82 | ALDH1A1 (0.54) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL11563826 | 0.81 | MAOB (0.48) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL8859293 | 0.81 | MAOB (0.48) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL28674798 | 0.80 | NFE2L2 (0.59) | KMT2ARAB9AALDH1A1TRPA1IDO1 | |
| SCHEMBL28670641 | 0.76 | RELA (0.63) | KMT2ARAB9AMAPTMEN1GAA | |
| SCHEMBL622876 | 0.75 | MAOB (0.56) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL14491222 | 0.75 | MAOB (0.56) | KMT2ARAB9AMAPTLMNAMEN1 | |
| SCHEMBL260495 | 0.75 | MAOB (0.56) | KMT2ARAB9AMAPTLMNAMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-113717228-A | Beta-phosphinic lactam compound and preparation method thereof | 北京化工大学 | 2021-11-30 | — | — | CN | disclosed |