Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.36 |
| ▸ | MAPT | P10636 | 4/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.36 |
| ▸ | NPC1 | O15118 | 3/20 | 0.36 |
| ▸ | HPGD | P15428 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.35 |
| ▸ | PTPRC | P08575 | 2/20 | 0.34 |
| ▸ | MYC | P01106 | 1/20 | 0.33 |
| ▸ | CA1 | P00915 | 1/20 | 0.33 |
| ▸ | CA2 | P00918 | 1/20 | 0.33 |
| ▸ | CA7 | P43166 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL23914735 | 0.80 | KDM4E (0.40) | ALDH1A1MAPTKMT2ANPC1HPGD | |
| SCHEMBL23966828 | 0.79 | ALDH1A1 (0.40) | ALDH1A1MAPTKMT2ANPC1HPGD | |
| SCHEMBL25310592 | 0.69 | ALDH1A1 (0.59) | ALDH1A1KMT2AHPGDMEN1TSHR | |
| SCHEMBL2556108 | 0.65 | MTNR1A (0.42) | ALDH1A1KMT2AKDM4ESMN1; SMN2 | |
| SCHEMBL23909086 | 0.63 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2AHPGDMEN1 | |
| SCHEMBL16410354 | 0.63 | MTNR1A (0.39) | ALDH1A1KMT2AHPGDKDM4ESMN1; SMN2 | |
| SCHEMBL23909087 | 0.63 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2AHPGDMEN1 | |
| SCHEMBL23915344 | 0.63 | ALDH1A1 (0.47) | ALDH1A1MAPTKMT2AHPGDMEN1 | |
| SCHEMBL18954763 | 0.63 | ALDH1A1 (0.71) | ALDH1A1MAPTKMT2AHPGDMEN1 | |
| SCHEMBL166198 | 0.63 | ALOX15 (0.52) | ALDH1A1KMT2ANPC1HPGDRAB9A |
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-3649119-B1 | NOVEL COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS THEREOF FOR THE TREATMENT OF FIBROSIS | GALAPAGOS NV (BE) | 2021-11-03 | — | — | EP | disclosed |