Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.45 |
| ▸ | ESR1 | P03372 | 1/20 | 0.43 |
| ▸ | PARP1 | P09874 | 2/20 | 0.43 |
| ▸ | NAMPT | P43490 | 1/20 | 0.42 |
| ▸ | AVPR1A | P37288 | 1/20 | 0.42 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.40 |
| ▸ | TNKS | O95271 | 1/20 | 0.39 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11348088 | 0.91 | SPR (0.47) | ALDH1A1ESR1PARP1NAMPTAVPR1A | |
| SCHEMBL11346625 | 0.87 | ALDH1A1 (0.45) | ALDH1A1ESR1PARP1NAMPTAVPR1A | |
| SCHEMBL11354008 | 0.87 | ALDH1A1 (0.47) | ALDH1A1ESR1PARP1NAMPTAVPR1A | |
| SCHEMBL11235502 | 0.84 | AVPR1A (0.47) | ESR1PARP1NAMPTAVPR1AADAMTS5 | |
| SCHEMBL11347533 | 0.84 | ALDH1A1 (0.55) | ALDH1A1ESR1LMNAPKMSMN1; SMN2 | |
| SCHEMBL11348285 | 0.83 | ALDH1A1 (0.45) | ALDH1A1ESR1PARP1NAMPTADAMTS5 | |
| SCHEMBL11227428 | 0.83 | SIGMAR1 (0.50) | — | |
| SCHEMBL11352649 | 0.83 | ALDH1A1 (0.51) | ALDH1A1ESR1PARP1NAMPTADAMTS5 | |
| SCHEMBL11343383 | 0.80 | AVPR1A (0.56) | ALDH1A1ESR1AVPR1ALMNASMN1; SMN2 | |
| SCHEMBL11347103 | 0.80 | MTNR1A (0.48) | ALDH1A1ESR1PARP1LMNA |
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 |
|---|---|---|---|---|---|---|---|
| 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 |