Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | TSHR | P16473 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.44 |
| ▸ | HTR1A | P08908 | 1/20 | 0.44 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.44 |
| ▸ | HTR7 | P34969 | 1/20 | 0.44 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL11243577 | 0.90 | SIGMAR1 (0.52) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11226385 | 0.86 | SIGMAR1 (0.50) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11226424 | 0.86 | SIGMAR1 (0.52) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11343261 | 0.83 | ALDH1A1 (0.45) | — | |
| SCHEMBL11344788 | 0.82 | HTR1A (0.55) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11249534 | 0.82 | SIGMAR1 (0.50) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11252927 | 0.81 | SIGMAR1 (0.54) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11246382 | 0.78 | HTR1A (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11237394 | 0.78 | KCNH2 (0.59) | KCNH2HTR1ASLC6A4HTR7DRD2 | |
| SCHEMBL11240999 | 0.78 | SIGMAR1 (0.55) | SIGMAR1MEN1TP53CYP1A2CYP3A4 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0007399-B1 | INDOLYLALKYL AMINES, PHARMACEUTICAL PREPARATIONS CONTAINING THEM AND PROCESS FOR THEIR MANUFACTURE | MERCK PATENT GmbH (DE) | 1982-01-20 | — | — | EP | disclosed |
| US-4251538-A | Indolealkylamines and processes for their preparation | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1981-02-17 | — | — | US | disclosed |
| EP-0007399-A1 | Indolylalkyl amines, pharmaceutical preparations containing them and process for their manufacture | MERCK PATENT GmbH (DE) | 1980-02-06 | — | — | EP | disclosed |