Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2A | P28223 | 7/20 | 0.60 |
| ▸ | HTR2C | P28335 | 5/20 | 0.60 |
| ▸ | DRD2 | P14416 | 4/20 | 0.59 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.57 |
| ▸ | MEN1 | O00255 | 1/20 | 0.57 |
| ▸ | TP53 | P04637 | 1/20 | 0.57 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.57 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.57 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.57 |
| ▸ | TSHR | P16473 | 1/20 | 0.57 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.57 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.57 |
| ▸ | TLR9 | Q9NR96 | 1/20 | 0.53 |
| ▸ | PARP1 | P09874 | 1/20 | 0.50 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.50 |
| ▸ | CHRNA7 | P36544 | 1/20 | 0.50 |
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 | |
|---|---|---|---|---|
| SCHEMBL11228025 | 0.87 | SIGMAR1 (0.59) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11260031 | 0.84 | SIGMAR1 (0.55) | DRD2SIGMAR1MEN1TP53CYP1A2 | |
| SCHEMBL5424647 | 0.84 | HTR2A (0.62) | HTR2AHTR2CDRD2MEN1KMT2A | |
| SCHEMBL11251485 | 0.82 | SIGMAR1 (0.53) | DRD2SIGMAR1MEN1TP53CYP1A2 | |
| SCHEMBL11342351 | 0.80 | ESR1 (0.60) | HTR2AHTR2CDRD2PARP1PARP2 | |
| SCHEMBL11784439 | 0.80 | CHRNA7 (0.56) | HTR2AHTR2CDRD2KCNH2CHRNA7 | |
| SCHEMBL11359930 | 0.79 | PARP1 (0.53) | DRD2SIGMAR1MEN1TP53CYP1A2 | |
| SCHEMBL5427628 | 0.77 | MEN1 (0.59) | HTR2AHTR2CDRD2MEN1KMT2A | |
| SCHEMBL5415363 | 0.77 | HTR2A (0.53) | HTR2AHTR2CDRD2SIGMAR1MEN1 | |
| SCHEMBL5417422 | 0.77 | HTR2A (0.56) | HTR2AHTR2CDRD2KCNH2TLR9 |
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 |