Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | HSD11B1 | P28845 | 3/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.49 |
| ▸ | TPSAB1 | Q15661 | 2/20 | 0.46 |
| ▸ | ACKR3 | P25106 | 1/20 | 0.45 |
| ▸ | ADAMTS5 | Q9UNA0 | 1/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.43 |
| ▸ | HPGD | P15428 | 1/20 | 0.43 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD4 | P21917 | 1/20 | 0.43 |
| ▸ | DRD3 | P35462 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 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 | |
|---|---|---|---|---|
| SCHEMBL11229177 | 0.88 | TPSAB1 (0.56) | ALDH1A1AVPR1ATPSAB1ESR1DRD2 | |
| SCHEMBL11223947 | 0.88 | AVPR1A (0.62) | AVPR1ATPSAB1ESR1DRD2DRD4 | |
| SCHEMBL11251234 | 0.88 | AVPR1A (0.49) | ALDH1A1SMN1; SMN2MAPTAVPR1ATPSAB1 | |
| SCHEMBL11314928 | 0.88 | KMT2A (0.50) | ALDH1A1SMN1; SMN2AVPR1ATPSAB1NPC1 | |
| SCHEMBL11221344 | 0.87 | TPSAB1 (0.48) | AVPR1ATPSAB1ADAMTS5ESR1DRD2 | |
| SCHEMBL11223398 | 0.87 | ADAM17 (0.57) | ALDH1A1MAPTAVPR1ATPSAB1NPC1 | |
| SCHEMBL11230105 | 0.86 | AVPR1A (0.48) | SMN1; SMN2MAPTAVPR1ATPSAB1NPC1 | |
| SCHEMBL11233891 | 0.85 | AVPR1A (0.47) | AVPR1ATPSAB1ESR1DRD2DRD4 | |
| SCHEMBL11251330 | 0.85 | SMN1; SMN2 (0.56) | ALDH1A1SMN1; SMN2HSD11B1MAPTNPC1 | |
| SCHEMBL11234418 | 0.83 | TPSAB1 (0.46) | HSD11B1AVPR1ATPSAB1ACKR3ADAMTS5 |
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 |