Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.42 |
| ▸ | HPGD | P15428 | 3/20 | 0.42 |
| ▸ | MAPT | P10636 | 2/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.42 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.42 |
| ▸ | SCN10A | Q9Y5Y9 | 2/20 | 0.41 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | HTR3E | A5X5Y0 | 1/20 | 0.36 |
| ▸ | HTR3B | O95264 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1358510 | 0.80 | ALDH1A1 (0.58) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL31267625 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL16306688 | 0.79 | ALDH1A1 (0.51) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL1835419 | 0.79 | ALPL (0.51) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL3885700 | 0.76 | NPBWR1 (0.55) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL16138051 | 0.76 | SMN1; SMN2 (0.74) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL3500120 | 0.75 | ALDH1A1 (0.48) | ALDH1A1KDM4EHPGDMAPTHSD17B10 | |
| SCHEMBL21822330 | 0.75 | PIN1 (0.54) | — | |
| SCHEMBL15111051 | 0.75 | ALDH1A1 (0.40) | ALDH1A1KDM4EHPGDMAPTCYP1A2 | |
| SCHEMBL28204180 | 0.75 | MEN1 (0.42) | ALDH1A1KDM4EHPGDMAPTCYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3009424-B1 | BICYCLIC NITROGEN-CONTAINING AROMATIC HETEROCYCLIC AMIDE COMPOUND | ASTELLAS PHARMA INC (JP) | 2017-12-20 | — | — | EP | disclosed |
| EP-3009424-A1 | BICYCLIC NITROGEN-CONTAINING AROMATIC HETEROCYCLIC AMIDE COMPOUND | Astellas Pharma Inc. (JP) | 2016-04-20 | — | — | EP | disclosed |