Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | HPGD | P15428 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | MGLL | Q99685 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | DRD2 | P14416 | 1/20 | 0.40 |
| ▸ | ACHE | P22303 | 1/20 | 0.39 |
| ▸ | BACE1 | P56817 | 1/20 | 0.39 |
| ▸ | MRGPRX1 | Q96LB2 | 1/20 | 0.39 |
| ▸ | KDM1A | O60341 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22491592 | 1.00 | KDM4E (0.41) | KDM4EALDH1A1HSD17B10HPGDNPC1 | |
| SCHEMBL29734550 | 0.87 | GPR119 (0.49) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL22773230 | 0.87 | GPR119 (0.49) | ALDH1A1NPC1RAB9AMEN1KMT2A | |
| SCHEMBL22491538 | 0.83 | LMNA (0.50) | ALDH1A1MGLLLMNAMRGPRX1MEN1 | |
| SCHEMBL22491428 | 0.83 | LMNA (0.50) | ALDH1A1MGLLLMNAMRGPRX1MEN1 | |
| SCHEMBL22773295 | 0.81 | PDE4D (0.46) | ALDH1A1SMN1; SMN2MGLLLMNA | |
| SCHEMBL22491574 | 0.81 | PDE4D (0.46) | ALDH1A1SMN1; SMN2MGLLLMNA | |
| SCHEMBL21381622 | 0.80 | SLC6A4 (0.49) | KDM1A | |
| SCHEMBL30567950 | 0.80 | SLC6A4 (0.49) | KDM1A | |
| SCHEMBL23211921 | 0.78 | MGLL (0.61) | MGLL |
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-3717477-A1 | NEW HETEROCYCLIC COMPOUNDS | H. Hoffnabb-La Roche Ag (CH) | 2020-10-07 | — | — | EP | disclosed |