Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 1/20 | 0.48 |
| ▸ | PARP1 | P09874 | 1/20 | 0.46 |
| ▸ | KIF11 | P52732 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 4/20 | 0.44 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 2/20 | 0.42 |
| ▸ | NPC1 | O15118 | 1/20 | 0.42 |
| ▸ | TP53 | P04637 | 1/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.42 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | TPSAB1 | Q15661 | 1/20 | 0.42 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.41 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.41 |
| ▸ | TACR1 | P25103 | 1/20 | 0.41 |
| ▸ | TLR9 | Q9NR96 | 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 | |
|---|---|---|---|---|
| SCHEMBL11348678 | 0.90 | AVPR1A (0.48) | ESR1PARP1ADAMTS5KMT2ATACR1 | |
| SCHEMBL11239836 | 0.90 | ESR1 (0.56) | ESR1PARP1MAPTKMT2ARAB9A | |
| SCHEMBL11347461 | 0.89 | ALDH1A1 (0.53) | ESR1MAPTKMT2ARAB9ANPC1 | |
| SCHEMBL11351370 | 0.84 | ESR1 (0.52) | ESR1PARP1KIF11MAPTKMT2A | |
| SCHEMBL11785518 | 0.83 | GAA (0.54) | KIF11MAPTKMT2ARAB9ANPC1 | |
| SCHEMBL11229177 | 0.82 | TPSAB1 (0.56) | ESR1PARP1RAB9AALDH1A1TPSAB1 | |
| SCHEMBL11239440 | 0.82 | KMT2A (0.53) | ESR1MAPTKMT2ARAB9ANPC1 | |
| SCHEMBL11239643 | 0.78 | ESR1 (0.57) | ESR1PARP1ADAMTS5 | |
| SCHEMBL11351356 | 0.78 | ESR1 (0.54) | ESR1PARP1MAPTADAMTS5SMN1; SMN2 | |
| SCHEMBL11347533 | 0.75 | ALDH1A1 (0.55) | ESR1MAPTKMT2ASMN1; SMN2ALDH1A1 |
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 |