Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR4 | P51679 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.40 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.40 |
| ▸ | IL1RN | P18510 | 1/20 | 0.39 |
| ▸ | KEAP1 | Q14145 | 1/20 | 0.39 |
| ▸ | ERAP1 | Q9NZ08 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | SLC40A1 | Q9NP59 | 1/20 | 0.38 |
| ▸ | EGFR | P00533 | 1/20 | 0.38 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.37 |
| ▸ | EDNRB | P24530 | 1/20 | 0.37 |
| ▸ | EDNRA | P25101 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | PKM | P14618 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL23746994 | 0.85 | EGFR (0.45) | CCR4HPGDKDM4ENPSR1RXFP1 | |
| SCHEMBL23747096 | 0.82 | EDNRA (0.42) | KDM4EEDNRBEDNRAALDH1A1PKM | |
| SCHEMBL23747082 | 0.82 | CCR4 (0.46) | CCR4HSD17B10SLC40A1EDNRBEDNRA | |
| SCHEMBL23747092 | 0.81 | FFAR4 (0.44) | SMN1; SMN2ALDH1A1 | |
| SCHEMBL23747030 | 0.75 | FKBP1A (0.43) | HPGDKDM4ELMNAHSD17B10EDNRB | |
| SCHEMBL23747216 | 0.75 | EDNRB (0.40) | CCR4HPGDKDM4ECYP2C9LMNA | |
| SCHEMBL23746985 | 0.74 | ALDH1A1 (0.49) | HPGDKDM4EHSD17B10SMN1; SMN2ALDH1A1 | |
| SCHEMBL23747016 | 0.74 | CHRNA7 (0.41) | EGLN2 | |
| SCHEMBL23747109 | 0.73 | CHRNA7 (0.41) | HPGDLMNAMEN1ALDH1A1KMT2A | |
| SCHEMBL23747149 | 0.72 | PTGS1 (0.35) | — |
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-2021158516-A1 | IRE1α MODULATORS AND USES THEREOF | NIMBUS IASO, INC. (US) | 2021-08-12 | — | — | WO | disclosed |