Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.47 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.47 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.47 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.42 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.42 |
| ▸ | HTR7 | P34969 | 3/20 | 0.42 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9581735 | 0.87 | SIGMAR1 (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10649693 | 0.82 | DRD4 (0.46) | SIGMAR1 | |
| SCHEMBL11247593 | 0.81 | SIGMAR1 (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10413760 | 0.78 | SLC18A3 (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10412929 | 0.76 | SLC18A3 (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11240999 | 0.75 | SIGMAR1 (0.55) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10652767 | 0.75 | DRD2 (0.48) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL10647445 | 0.75 | HTR1A (0.52) | — | |
| SCHEMBL11226424 | 0.75 | SIGMAR1 (0.52) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11243577 | 0.75 | SIGMAR1 (0.52) | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0144012-B1 | INDOLE DERIVATIVES | MERCK PATENT GmbH (DE) | 1988-03-16 | — | — | EP | disclosed |
| EP-0144012-A1 | Indole derivatives | MERCK PATENT GmbH (DE) | 1985-06-12 | — | — | EP | disclosed |