Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR1 | P03372 | 2/20 | 0.58 |
| ▸ | PARP1 | P09874 | 2/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.47 |
| ▸ | MAPK10 | P53779 | 1/20 | 0.47 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | HPGD | P15428 | 1/20 | 0.46 |
| ▸ | ADAMTS5 | Q9UNA0 | 3/20 | 0.46 |
| ▸ | NAMPT | P43490 | 1/20 | 0.45 |
| ▸ | BCHE | P06276 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | TLR9 | Q9NR96 | 2/20 | 0.44 |
| ▸ | TLR8 | Q9NR97 | 2/20 | 0.44 |
| ▸ | TLR7 | Q9NYK1 | 2/20 | 0.44 |
| ▸ | TNKS | O95271 | 1/20 | 0.44 |
| ▸ | PARP2 | Q9UGN5 | 1/20 | 0.44 |
| ▸ | USP2 | O75604 | 1/20 | 0.43 |
| ▸ | HTR7 | P34969 | 3/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL11348655 | 0.92 | ESR1 (0.56) | ESR1PARP1HSD17B10MAPK10SMN1; SMN2 | |
| SCHEMBL11335727 | 0.89 | ESR1 (0.61) | ESR1PARP1HSD17B10MAPK10SMN1; SMN2 | |
| SCHEMBL11342351 | 0.85 | ESR1 (0.60) | ESR1PARP1TNKSPARP2 | |
| SCHEMBL11351356 | 0.82 | ESR1 (0.54) | ESR1PARP1HSD17B10MAPK10SMN1; SMN2 | |
| SCHEMBL11260031 | 0.81 | SIGMAR1 (0.55) | PARP1BCHEPARP2 | |
| SCHEMBL11231076 | 0.81 | ESR1 (0.52) | ESR1PARP1HSD17B10MAPK10SMN1; SMN2 | |
| SCHEMBL11223035 | 0.79 | OXER1 (0.55) | ESR1PARP1HSD17B10MAPK10SMN1; SMN2 | |
| SCHEMBL11351370 | 0.79 | ESR1 (0.52) | ESR1PARP1KDM4EALDH1A1MAPT | |
| SCHEMBL11222496 | 0.77 | ESR1 (0.51) | ESR1PARP1ALDH1A1MAPTTLR9 | |
| SCHEMBL11233209 | 0.77 | ALDH1A1 (0.71) | ESR1PARP1HSD17B10SMN1; SMN2KDM4E |
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 |