Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.41 |
| ▸ | HTR4 | Q13639 | 5/20 | 0.40 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.40 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.40 |
| ▸ | HTR3A | P46098 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL7336661 | 0.83 | HTR4 (0.46) | HTR4SIGMAR1TMEM97HTR3A | |
| SCHEMBL5338383 | 0.79 | CHRM3 (0.48) | DRD2SIGMAR1 | |
| SCHEMBL8294935 | 0.75 | HTR4 (0.50) | HTR4 | |
| Hydrochloric Acid SCHEMBL7533240 | 0.74 | HTR4 (0.49) | HTR4 | |
| Hydrochloric Acid SCHEMBL7537446 | 0.73 | HTR4 (0.48) | HTR4 | |
| SCHEMBL13980609 | 0.71 | SIGMAR1 (0.46) | DRD2SIGMAR1 | |
| SCHEMBL13980606 | 0.70 | SIGMAR1 (0.41) | DRD2SIGMAR1 | |
| SCHEMBL2361077 | 0.70 | HTR4 (0.71) | HTR4SIGMAR1TMEM97HTR3A | |
| SCHEMBL3297555 | 0.70 | HTR4 (0.61) | HTR4 | |
| SCHEMBL2337246 | 0.69 | DRD4 (0.51) | DRD2SIGMAR1TMEM97 |
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 |
|---|---|---|---|---|---|---|---|
| US-6002009-A | Di-substituted 1,4-piperidine esters and amides having 5-HT4 antagonistic activity | BOEHRINGER INGELHEIM ITALIA, S.P.A. (IT) | 1999-12-14 | — | — | US | disclosed |