Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA9 | Q16790 | 5/20 | 0.83 |
| ▸ | CA12 | O43570 | 4/20 | 0.83 |
| ▸ | ALDH1A1 | P00352 | 13/20 | 0.73 |
| ▸ | KDM4E | B2RXH2 | 12/20 | 0.73 |
| ▸ | HPGD | P15428 | 11/20 | 0.73 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.73 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.73 |
| ▸ | RAB9A | P51151 | 4/20 | 0.73 |
| ▸ | MEN1 | O00255 | 3/20 | 0.73 |
| ▸ | NPC1 | O15118 | 3/20 | 0.73 |
| ▸ | POLB | P06746 | 1/20 | 0.73 |
| ▸ | ATM | Q13315 | 2/20 | 0.64 |
| ▸ | LMNA | P02545 | 2/20 | 0.62 |
| ▸ | GLA | P06280 | 2/20 | 0.62 |
| ▸ | GAA | P10253 | 1/20 | 0.62 |
| ▸ | HSD17B10 | Q99714 | 7/20 | 0.59 |
| ▸ | TSHR | P16473 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 1/20 | 0.58 |
| ▸ | THRB | P10828 | 1/20 | 0.58 |
| ▸ | CASP1 | P29466 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL18095542 | 0.90 | CA12 (0.71) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18095375 | 0.90 | ALDH1A1 (0.72) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL20554014 | 0.90 | CA12 (0.83) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18095333 | 0.84 | KMT2A (0.76) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL20553869 | 0.84 | NPC1 (0.76) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18095433 | 0.82 | ALDH1A1 (0.70) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL20553972 | 0.81 | KMT2A (0.83) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18095492 | 0.81 | KDM4E (0.59) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18095309 | 0.81 | CA12 (0.69) | CA9CA12ALDH1A1KDM4EHPGD | |
| SCHEMBL18099121 | 0.78 | KMT2A (0.76) | CA9CA12ALDH1A1KDM4EHPGD |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3256120-B1 | PSORALEN DERIVATIVES AS NON-PEPTIDIC INHIBITORS OF CHYMOTRYPSIN-LIKE ACTIVITY OF THE IMMUNOPROTEASOME | UNIV LJUBLJANI (SI) | 2018-11-14 | — | — | EP | disclosed |
| EP-3256120-A1 | PSORALEN DERIVATIVES AS NON-PEPTIDIC INHIBITORS OF CHYMOTRYPSIN-LIKE ACTIVITY OF THE IMMUNOPROTEASOME | Univerza v Ljubljani (SI) | 2017-12-20 | — | — | EP | disclosed |
| WO-2016151483-A1 | PSORALEN DERIVATIVES AS NON-PEPTIDIC INHIBITORS OF CHYMOTRYPSIN-LIKE ACTIVITY OF THE IMMUNOPROTEASOME | UNIVERZA V LJUBLJANI (SI) | 2016-09-29 | — | — | WO | disclosed |
| WO-2016151483-A1 | PSORALEN DERIVATIVES AS NON-PEPTIDIC INHIBITORS OF CHYMOTRYPSIN-LIKE ACTIVITY OF THE IMMUNOPROTEASOME | UNIVERZA V LJUBLJANI (SI) | 2016-09-29 | — | — | WO | disclosed |