Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RECQL | P46063 | 1/20 | 0.49 |
| ▸ | MAPT | P10636 | 2/20 | 0.48 |
| ▸ | FBP1 | P09467 | 1/20 | 0.47 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.45 |
| ▸ | HPGD | P15428 | 2/20 | 0.45 |
| ▸ | NOS2 | P35228 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 2/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PKM | P14618 | 1/20 | 0.42 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.42 |
| ▸ | AOC3 | Q16853 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 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 | |
|---|---|---|---|---|
| SCHEMBL8513394 | 0.88 | RECQL (0.59) | RECQLMAPTCYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL14365801 | 0.85 | MAPT (0.49) | MAPTFBP1ALDH1A1HPGDSMN1; SMN2 | |
| SCHEMBL14365742 | 0.84 | ROCK2 (0.54) | MAPTSMN1; SMN2LMNA | |
| SCHEMBL13853740 | 0.84 | F10 (0.54) | — | |
| SCHEMBL13853440 | 0.83 | NAMPT (0.54) | MAPTFBP1CYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL8191596 | 0.83 | RECQL (0.51) | RECQLMAPTCYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL13853490 | 0.81 | FBP1 (0.58) | FBP1ALDH1A1HPGDSMN1; SMN2POLB | |
| SCHEMBL14289839 | 0.81 | CYP1A2 (0.53) | MAPTLMNAPKMKMT2AKDM4E | |
| SCHEMBL7041171 | 0.81 | CYP2C9 (0.58) | RECQLMAPTCYP2C9CYP2C19ALDH1A1 | |
| SCHEMBL24782509 | 0.81 | SLC7A5 (0.57) | RECQLHPGDLMNAKMT2A |
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-3037410-B1 | METHOD FOR PRODUCING M-XYLYLENE DIISOCYANATE | MITSUI CHEMICALS INC (JP) | 2018-04-11 | — | — | EP | disclosed |