Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 3/20 | 0.35 |
| ▸ | GRM8 | O00222 | 2/20 | 0.35 |
| ▸ | GRM6 | O15303 | 2/20 | 0.35 |
| ▸ | GRM3 | Q14832 | 2/20 | 0.35 |
| ▸ | DDB1 | Q16531 | 1/20 | 0.34 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.34 |
| ▸ | RHEB | Q15382 | 1/20 | 0.33 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
| ▸ | CES1 | P23141 | 1/20 | 0.32 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 2/20 | 0.32 |
| ▸ | CXCR2 | P25025 | 1/20 | 0.32 |
| ▸ | CA2 | P00918 | 1/20 | 0.31 |
| ▸ | CA4 | P22748 | 1/20 | 0.31 |
| ▸ | GRM5 | P41594 | 1/20 | 0.31 |
| ▸ | TERT | O14746 | 1/20 | 0.31 |
| ▸ | RECQL | P46063 | 1/20 | 0.31 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.31 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL1146608 | 0.77 | SLC6A4 (0.38) | GRM2GRM8GRM6GRM3DDB1 | |
| SCHEMBL3651167 | 0.74 | GRM2 (0.36) | GRM2GRM8GRM6GRM3DDB1 | |
| SCHEMBL19121400 | 0.73 | DDB1 (0.37) | DDB1CRBNRHEBCES2CES1 | |
| SCHEMBL24199367 | 0.73 | MAOA (0.42) | CRBNALDH1A1DAOL3MBTL1MEN1 | |
| SCHEMBL4908425 | 0.72 | DDB1 (0.39) | DDB1CRBNRHEBCES2CES1 | |
| SCHEMBL24952543 | 0.72 | GRM5 (0.42) | DDB1CRBNRHEBCES2CES1 | |
| SCHEMBL20714805 | 0.71 | AR (0.49) | GRM2CA2RECQLMEN1KMT2A | |
| SCHEMBL4420868 | 0.71 | HTR2A (0.35) | GRM2GRM8GRM6GRM3DDB1 | |
| SCHEMBL34470857 | 0.69 | ALDH1A1 (0.36) | GRM2GRM8GRM6GRM3KDM4E | |
| SCHEMBL14666345 | 0.69 | KMT2A (0.47) | KDM4EALDH1A1DAOL3MBTL1MEN1 |
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-3798214-A1 | MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR | Vertex Pharmaceuticals Incorporated (US) | 2021-03-31 | — | — | EP | disclosed |