Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | FDPS | P14324 | 1/20 | 0.47 |
| ▸ | NR4A1 | P22736 | 1/20 | 0.45 |
| ▸ | NR4A2 | P43354 | 1/20 | 0.45 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.43 |
| ▸ | TSHR | P16473 | 1/20 | 0.43 |
| ▸ | RAB9A | P51151 | 2/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | FGFR1 | P11362 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL27633478 | 0.89 | ALDH1A1 (0.50) | SMN1; SMN2FDPSNR4A1NR4A2NOTUM | |
| SCHEMBL1345334 | 0.85 | SMN1; SMN2 (0.46) | SMN1; SMN2FDPSNR4A1NR4A2NOTUM | |
| SCHEMBL7443999 | 0.85 | SMN1; SMN2 (0.46) | SMN1; SMN2FDPSNR4A1NR4A2NOTUM | |
| SCHEMBL22290363 | 0.84 | NR4A1 (0.49) | SMN1; SMN2NR4A1NR4A2NOTUMALDH1A1 | |
| SCHEMBL23884809 | 0.81 | ALDH1A1 (0.59) | SMN1; SMN2NR4A1NR4A2ALDH1A1MEN1 | |
| SCHEMBL11177528 | 0.81 | AKT1 (0.43) | SMN1; SMN2FDPSNR4A1NR4A2NOTUM | |
| SCHEMBL27807039 | 0.81 | ALDH1A1 (0.48) | SMN1; SMN2FDPSALDH1A1CYP1A2CYP3A4 | |
| SCHEMBL22290179 | 0.81 | KMT2A (0.50) | SMN1; SMN2FDPSNR4A2ALDH1A1CYP1A2 | |
| SCHEMBL25778550 | 0.80 | KDM4E (0.66) | SMN1; SMN2ALDH1A1CYP3A4CYP2C9POLB | |
| SCHEMBL19651232 | 0.80 | NR4A1 (0.42) | NR4A1NR4A2GAA |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2018064119-A1 | CALPAIN MODULATORS AND THERAPEUTIC USES THEREOF | BLADE THERAPEUTICS, INC. (US) | 2018-04-05 | — | — | WO | disclosed |
| WO-2009117676-A2 | NOVEL PIPERIDINE DERIVATIVES AS INHIBITORS OF STEAROYL-COA DESATURASE | FOREST LABORATORIES HOLDINGS LIMITED (BM) | 2009-09-24 | — | — | WO | disclosed |
| EP-0125783-B1 | DOPAMINE-BETA-HYDROXYLASE INHIBITORS | SMITHKLINE BECKMAN CORPORATION (US) | 1989-01-04 | — | — | EP | disclosed |