Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.43 |
| ▸ | CHRM5 | P08912 | 2/20 | 0.41 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.41 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.41 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.40 |
| ▸ | HTR4 | Q13639 | 3/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | GRM4 | Q14833 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TP53 | P04637 | 2/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | EGFR | P00533 | 1/20 | 0.39 |
| ▸ | KDR | P35968 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL8633396 | 0.90 | CHRM5 (0.41) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| SCHEMBL8628426 | 0.89 | LMNA (0.44) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| Hydrochloric Acid SCHEMBL8631929 | 0.86 | AVPR2 (0.51) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| Hydrochloric Acid SCHEMBL8634036 | 0.83 | AVPR2 (0.51) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| SCHEMBL4684433 | 0.82 | AVPR2 (0.49) | CHRM5CHRM1CHRM3HTR4GRM4 | |
| Hydrochloric Acid SCHEMBL8661678 | 0.82 | AVPR2 (0.52) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| SCHEMBL8632070 | 0.82 | GRM4 (0.40) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| SCHEMBL8631926 | 0.81 | AVPR2 (0.44) | ALDH1A1CHRM5CHRM1CHRM3LMNA | |
| SCHEMBL8632575 | 0.80 | AVPR2 (0.46) | CHRM5CHRM1CHRM3LMNATP53 | |
| SCHEMBL8632028 | 0.78 | GRM4 (0.41) | ALDH1A1CHRM5CHRM1CHRM3LMNA |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0906315-A1 | SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LTD. (GB) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997049710-A1 | SPIRO-PIPERIDINE DERIVATIVES AND THEIR USE AS THERAPEUTIC AGENTS | MERCK SHARP & DOHME LIMITED (GB) | 1997-12-31 | — | — | WO | disclosed |