Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK4 | P11802 | 1/20 | 0.46 |
| ▸ | CCND1 | P24385 | 1/20 | 0.46 |
| ▸ | CXCR3 | P49682 | 1/20 | 0.45 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HRH1 | P35367 | 1/20 | 0.44 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.44 |
| ▸ | UTS2R | Q9UKP6 | 9/20 | 0.43 |
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | BLM | P54132 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.42 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.42 |
| ▸ | CNR1 | P21554 | 1/20 | 0.42 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.42 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL11113464 | 0.85 | DRD2 (0.63) | CDK4CCND1SLC6A9DRD2LMNA | |
| SCHEMBL11116808 | 0.78 | DRD2 (0.45) | SLC6A9HDAC6DRD2NPSR1 | |
| SCHEMBL11114924 | 0.76 | SIGMAR1 (0.51) | HTR2AHRH1TMEM97SIGMAR1 | |
| SCHEMBL11407684 | 0.75 | ALDH1A1 (0.56) | HTR2AHRH1BLMLMNANPSR1 | |
| SCHEMBL11210779 | 0.73 | KMT2A (0.56) | CDK4CCND1HDAC6 | |
| SCHEMBL7627273 | 0.72 | HRH1 (0.46) | SLC6A9HTR2AHRH1UTS2RBLM | |
| SCHEMBL10778672 | 0.72 | HTR2A (0.78) | HTR2AHRH1UTS2RBLMLMNA | |
| SCHEMBL7274896 | 0.71 | HTR2A (0.55) | SLC6A9HTR2AHRH1LMNASIGMAR1 | |
| SCHEMBL10409938 | 0.70 | HTR2A (0.53) | HTR2AHRH1LMNACNR1SIGMAR1 | |
| SCHEMBL9117039 | 0.69 | MEN1 (0.59) | CDK4CCND1HTR2AHRH1LMNA |
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 |