Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AGTR1 | P30556 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 5/20 | 0.41 |
| ▸ | MEN1 | O00255 | 4/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MAPK1 | P28482 | 4/20 | 0.41 |
| ▸ | HPGD | P15428 | 3/20 | 0.41 |
| ▸ | TSHR | P16473 | 3/20 | 0.41 |
| ▸ | ATM | Q13315 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.41 |
| ▸ | RAB9A | P51151 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | IMPDH2 | P12268 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL24309752 | 0.83 | MAPK1 (0.57) | AGTR1ALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL24310546 | 0.81 | MAPK1 (0.49) | ALDH1A1KDM4EMEN1KMT2AMAPK1 | |
| SCHEMBL11289134 | 0.78 | AGTR1 (0.56) | AGTR1NPSR1ALDH1A1MEN1KMT2A | |
| SCHEMBL24310288 | 0.77 | TSHR (0.57) | AGTR1LMNANPSR1ALDH1A1HPGD | |
| SCHEMBL29567077 | 0.77 | TSHR (0.57) | AGTR1LMNANPSR1ALDH1A1HPGD | |
| SCHEMBL24310302 | 0.76 | BRD4 (0.37) | AGTR1LMNANPSR1ALDH1A1KDM4E | |
| SCHEMBL24310176 | 0.76 | MAPK1 (0.51) | AGTR1LMNAALDH1A1KDM4EMEN1 | |
| SCHEMBL24309630 | 0.75 | ALDH1A1 (0.44) | LMNAALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL24310122 | 0.74 | GPR39 (0.49) | LMNAALDH1A1MEN1KMT2AMAPK1 | |
| SCHEMBL24309283 | 0.72 | TDP1 (0.46) | AGTR1LMNAALDH1A1KDM4EMEN1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022076627-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-14 | — | — | WO | disclosed |