Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | TP53 | P04637 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.52 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.52 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.49 |
| ▸ | OPRK1 | P41145 | 2/20 | 0.49 |
| ▸ | OPRD1 | P41143 | 1/20 | 0.48 |
| ▸ | OPRL1 | P41146 | 1/20 | 0.48 |
| ▸ | ADRA2A | P08913 | 1/20 | 0.47 |
| ▸ | ADRA2B | P18089 | 1/20 | 0.47 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.47 |
| ▸ | HTR7 | P34969 | 1/20 | 0.47 |
| ▸ | HTR2B | P41595 | 1/20 | 0.47 |
| ▸ | HTR6 | P50406 | 1/20 | 0.47 |
| ▸ | PARP1 | P09874 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL11244654 | 0.89 | SIGMAR1 (0.54) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11359930 | 0.87 | PARP1 (0.53) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11228025 | 0.87 | SIGMAR1 (0.59) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11226070 | 0.86 | HTR1D (0.51) | SIGMAR1MEN1TP53CYP1A2CYP3A4 | |
| SCHEMBL11787894 | 0.83 | CHRNA7 (0.52) | SIGMAR1KMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL11222496 | 0.82 | ESR1 (0.51) | MEN1TP53KMT2AADRA2AADRA2B | |
| SCHEMBL11338350 | 0.81 | CHRNA7 (0.50) | SIGMAR1KMT2AADRA2AADRA2BADRA2C | |
| SCHEMBL11326948 | 0.81 | CHRNA7 (0.50) | SIGMAR1ADRA2AADRA2BADRA2CHTR7 | |
| SCHEMBL11237394 | 0.80 | KCNH2 (0.59) | OPRM1OPRK1OPRL1HTR7HTR2B | |
| SCHEMBL11784439 | 0.80 | CHRNA7 (0.56) | — |
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-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 |