Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BID | P55957 | 5/20 | 0.42 |
| ▸ | MCL1 | Q07820 | 5/20 | 0.42 |
| ▸ | BCL2L1 | Q07817 | 4/20 | 0.42 |
| ▸ | BAK1 | Q16611 | 4/20 | 0.42 |
| ▸ | PPARA | Q07869 | 3/20 | 0.42 |
| ▸ | KAT8 | Q9H7Z6 | 2/20 | 0.42 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | SAE1 | Q9UBE0 | 2/20 | 0.42 |
| ▸ | EP300 | Q09472 | 1/20 | 0.42 |
| ▸ | KAT2A | Q92830 | 1/20 | 0.42 |
| ▸ | KAT2B | Q92831 | 1/20 | 0.42 |
| ▸ | KAT5 | Q92993 | 1/20 | 0.42 |
| ▸ | IAPP | P10997 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.39 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | LIPG | Q9Y5X9 | 1/20 | 0.38 |
| ▸ | HTT | P42858 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL8087557 | 0.95 | BID (0.48) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL8095850 | 0.94 | BID (0.50) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL8093905 | 0.94 | BID (0.50) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL8094232 | 0.94 | BID (0.50) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL8094950 | 0.90 | ALDH1A1 (0.37) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL1986794 | 0.85 | BID (0.50) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL18716719 | 0.85 | BID (0.43) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL3181025 | 0.84 | TSHR (0.44) | BIDMCL1BCL2L1BAK1PPARA | |
| SCHEMBL1892417 | 0.84 | GABRA1 (0.45) | CYP3A4TSHRHTTTDP1ALOX15 | |
| SCHEMBL486383 | 0.83 | MEN1 (0.45) | BIDMCL1BCL2L1BAK1PPARA |
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-0708077-B1 | Diamino compounds and methods for preparing them | CHISSO CORP (JP) | 2000-12-27 | — | — | EP | disclosed |
| US-5663440-A | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1997-09-02 | — | — | US | disclosed |
| EP-0708077-A1 | Diamino compounds and methods for preparing them | CHISSO CORPORATION (JP) | 1996-04-24 | — | — | EP | disclosed |