Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM5 | P41594 | 5/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 2/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | MAOA | P21397 | 3/20 | 0.34 |
| ▸ | MAOB | P27338 | 3/20 | 0.34 |
| ▸ | MAPT | P10636 | 3/20 | 0.33 |
| ▸ | USP2 | O75604 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.32 |
| ▸ | NPC1 | O15118 | 2/20 | 0.32 |
| ▸ | RAB9A | P51151 | 2/20 | 0.32 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.32 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.32 |
| ▸ | RELA | Q04206 | 1/20 | 0.32 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL1815313 | 0.77 | GRM5 (0.44) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL2485416 | 0.76 | GRM5 (0.48) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL30132531 | 0.75 | MAOA (0.47) | GRM5NPSR1KDM4EMAOAMAOB | |
| SCHEMBL20554683 | 0.75 | MAOA (0.47) | GRM5NPSR1KDM4EMAOAMAOB | |
| SCHEMBL4197008 | 0.73 | GRM5 (0.48) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL13482129 | 0.73 | GRM5 (0.44) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL4426496 | 0.73 | GRM5 (0.44) | GRM5TSHRMAOAMAOBMAPT | |
| SCHEMBL4423448 | 0.72 | GRM5 (0.54) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL23376853 | 0.71 | GRM5 (0.51) | GRM5ALDH1A1NPSR1KDM4ETSHR | |
| SCHEMBL22787232 | 0.71 | GRM5 (0.43) | GRM5ALDH1A1NPSR1KDM4ETSHR |
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-2592071-B1 | Tricyclic heterocyclic compounds | BRISTOL MYERS SQUIBB CO (US) | 2019-09-18 | — | — | EP | disclosed |