Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | PDE4B | Q07343 | 2/20 | 0.42 |
| ▸ | FKBP1A | P62942 | 2/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.41 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.41 |
| ▸ | CALM1 | P0DP23 | 1/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | PDE4A | P27815 | 2/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.40 |
| ▸ | PDE4D | Q08499 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | TNF | P01375 | 1/20 | 0.40 |
| ▸ | PDE4C | Q08493 | 1/20 | 0.40 |
| ▸ | PDE3B | Q13370 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL670425 | 0.85 | SLC6A4 (0.50) | ALDH1A1MEN1KMT2AKDM4EEPHX1 | |
| SCHEMBL670094 | 0.85 | SLC6A4 (0.50) | ALDH1A1MEN1KMT2AKDM4EEPHX1 | |
| SCHEMBL670518 | 0.85 | SLC6A4 (0.50) | ALDH1A1MEN1KMT2AKDM4EEPHX1 | |
| SCHEMBL17851251 | 0.77 | CYP3A4 (0.48) | MAPTALDH1A1CYP1A2MEN1KMT2A | |
| SCHEMBL15171307 | 0.75 | SLC6A4 (0.47) | MAPTALDH1A1MEN1KMT2AKDM4E | |
| Ammonia Solution, Strong SCHEMBL2999179 | 0.74 | CALM1 (0.54) | CYP2C9CYP2C19CYP1A2KDM4ECALM1 | |
| SCHEMBL7356214 | 0.71 | CYP3A4 (0.47) | MAPTALDH1A1CYP2C9CYP2C19KMT2A | |
| SCHEMBL11669744 | 0.70 | POLB (0.40) | ALDH1A1MEN1KMT2AKDM4ELMNA | |
| SCHEMBL13214223 | 0.70 | SLC6A4 (0.50) | CYP1A2MEN1KMT2AKDM4EEPHX1 | |
| SCHEMBL23509449 | 0.70 | CALM1 (0.47) | MAPTALDH1A1PDE4BMEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3068793-B1 | ENGINEERED IMINE REDUCTASES AND METHODS FOR THE REDUCTIVE AMINATION OF KETONE AND AMINE COMPOUNDS | CODEXIS INC (US) | 2021-02-17 | — | — | EP | disclosed |