Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.63 |
| ▸ | PTGDR2 | Q9Y5Y4 | 1/20 | 0.50 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.49 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.48 |
| ▸ | MAPT | P10636 | 3/20 | 0.48 |
| ▸ | HPGD | P15428 | 3/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | LMNA | P02545 | 2/20 | 0.47 |
| ▸ | POLB | P06746 | 1/20 | 0.47 |
| ▸ | GAA | P10253 | 1/20 | 0.47 |
| ▸ | PKM | P14618 | 1/20 | 0.47 |
| ▸ | RECQL | P46063 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | CNR1 | P21554 | 1/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | ACHE | P22303 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 4/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL11111247 | 0.85 | CDK4 (0.46) | DRD2SLC6A9LMNACNR1NPSR1 | |
| SCHEMBL11116808 | 0.83 | DRD2 (0.45) | DRD2SLC6A9ALDH1A1MAPTKDM4E | |
| SCHEMBL9117039 | 0.81 | MEN1 (0.59) | PTGDR2TDP1ALDH1A1MAPTHPGD | |
| SCHEMBL19479112 | 0.80 | DRD2 (0.74) | DRD2ALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL11130111 | 0.78 | TSHR (0.57) | SLC6A9TDP1ALDH1A1MAPTHPGD | |
| SCHEMBL19479124 | 0.78 | DRD2 (1.00) | DRD2MAPTACHEMEN1KMT2A | |
| SCHEMBL11110461 | 0.76 | TSHR (0.59) | TDP1ALDH1A1MAPTHPGDLMNA | |
| SCHEMBL13181408 | 0.76 | MLYCD (0.64) | DRD2MAPTHPGDKDM4EACHE | |
| SCHEMBL16941089 | 0.76 | DRD2 (0.59) | DRD2ALDH1A1MAPTHPGDKDM4E | |
| SCHEMBL11115848 | 0.74 | SIGMAR1 (0.55) | SLC6A9ALDH1A1MAPTHPGDLMNA |
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-0041757-B1 | ETHYLENDIAMINE DERIVATIVES, PREPARATION THEREOF, PHARMACEUTICAL COMPOSITIONS CONTAINING SAME AND INTERMEDIATES FOR THEIR PREPARATION | Simes S.p.A. (IT) | 1984-11-07 | — | — | EP | disclosed |
| EP-0041757-A1 | Ethylendiamine derivatives, preparation thereof, pharmaceutical compositions containing same and intermediates for their preparation | Simes S.p.A. (IT) | 1981-12-16 | — | — | EP | disclosed |