Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MLYCD | O95822 | 1/20 | 0.39 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.36 |
| ▸ | CTSK | P43235 | 3/20 | 0.35 |
| ▸ | GAA | P10253 | 3/20 | 0.34 |
| ▸ | MEN1 | O00255 | 1/20 | 0.34 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.34 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.34 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.34 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | GLA | P06280 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.34 |
| ▸ | ELANE | P08246 | 1/20 | 0.34 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8645031 | 0.82 | KDM4E (0.43) | MLYCDEPHX2TDP1GAAMEN1 | |
| SCHEMBL23612430 | 0.79 | MLYCD (0.34) | MLYCDEPHX2TDP1CTSKGAA | |
| SCHEMBL2799440 | 0.79 | TDP1 (0.56) | MLYCDEPHX2TDP1GAAMEN1 | |
| SCHEMBL16675239 | 0.77 | MLYCD (0.41) | MLYCDEPHX2TDP1GAAMEN1 | |
| Hydrochloric Acid SCHEMBL7451357 | 0.77 | MLYCD (0.41) | MLYCDEPHX2TDP1CTSKGAA | |
| SCHEMBL7664928 | 0.77 | MLYCD (0.41) | MLYCDEPHX2TDP1CTSKGAA | |
| SCHEMBL14396534 | 0.77 | MLYCD (0.41) | MLYCDEPHX2TDP1CTSKGAA | |
| SCHEMBL2608190 | 0.76 | MLYCD (0.39) | MLYCDEPHX2TDP1CTSKGAA | |
| SCHEMBL18940673 | 0.76 | TDP1 (0.59) | TDP1GAAMEN1KMT2AKDM4E | |
| SCHEMBL3485766 | 0.76 | EPHX2 (0.40) | MLYCDEPHX2TDP1CTSKGAA |
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-3573960-B1 | N-{[2-(PIPERIDIN-1-YL)PHENYL](PHENYL)METHYL}-2-(3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)ACETAMIDE DERIVATIVES AND RELATED COMPOUNDS AS ROR-GAMMA MODULATORS FOR TREATING AUTOIMMUNE DISEASES | GENFIT (FR) | 2023-08-16 | — | — | EP | disclosed |